smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COc1ccncc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 353840411 HMDOVXUAPZLSII-UHFFFAOYSA-N 287.275 2.180 5 50 CEBA C[C@H]1CN(c2cc(F)cc([N+](=O)[O-])c2)C[C@@H](C)O1 157894760 PPPZBHGHOGBOEF-DTORHVGOSA-N 254.261 2.348 5 50 CEBA O=c1oc2cc(OCc3nn[nH]n3)ccc2c2ccccc12 6140423 CPARTXROVKGLFD-UHFFFAOYSA-N 294.270 2.038 5 50 CEBA CC(C)(C)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 281120 MEQPFGBQZDMDDU-UHFFFAOYSA-N 257.311 2.308 5 50 CEBA O=[N+]([O-])c1ccc2nc3ncc([N+](=O)[O-])cc3c(O)c2c1 4552329 UCLSXTWAAIJHMP-UHFFFAOYSA-N 286.203 2.305 5 50 CEBA O=[N+]([O-])c1cnc(N2CCCN3CCC[C@H]3C2)c(Cl)c1 247322324 MIMLXJWUXGRGSO-JTQLQIEISA-N 296.758 2.318 5 50 CEBA COc1n[nH]c(C(=O)Nc2cc(C)ccc2F)c1[N+](=O)[O-] 1002374 ZOUXXIQVMPFEAP-UHFFFAOYSA-N 294.242 2.026 5 50 CEBA CS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F 44790273 QOJWKPYXDXSLLL-UHFFFAOYSA-N 269.200 2.017 5 50 CEBA COC(=O)c1cc(-c2c[nH]nc2C)cc([N+](=O)[O-])c1 725272906 VMKQSKXBPHPWKT-UHFFFAOYSA-N 261.237 2.080 5 50 CEBA O=C1C(Cl)=CCCN1c1ccc([N+](=O)[O-])cc1 38247346 DOUAPYNOGMHPFD-UHFFFAOYSA-N 252.657 2.454 5 50 CEBA in-vitro C[C@H](Nc1ccc([N+](=O)[O-])cn1)[C@@H](O)Cc1ccccc1 120644893 VSNNRMRJOHMCLC-FZMZJTMJSA-N 287.319 2.394 5 50 CEBA O=c1c([N+](=O)[O-])cccn1Cc1ccccc1Cl 108601 RQADPMVNKSDMGM-UHFFFAOYSA-N 264.668 2.458 5 50 CEBA COC(=O)c1ccc(Br)c([N+](=O)[O-])c1F 261493909 LTYAHOWZDAMGRQ-UHFFFAOYSA-N 278.033 2.283 5 50 CEBA O=C1CC[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])CCN1 396712805 PKNJWDXKAHCKAO-VIFPVBQESA-N 283.715 2.329 5 50 CEBA CC(C)(C)OC(=O)NOc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1717901 DTYVDGWQRMBFGP-UHFFFAOYSA-N 299.239 2.322 5 50 CEBA O=[N+]([O-])c1c(Br)ccc2nsnc12 983827 BPYYEVZFVMMYSS-UHFFFAOYSA-N 260.072 2.362 5 50 CEBA Cc1cc(OCCN2CCCC2)ccc1[N+](=O)[O-] 4845194 RTUIDSJXWGKYHC-UHFFFAOYSA-N 250.298 2.378 5 50 CEBA Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2CCCCN2C1=O 328595201 NZNVIFVLUJHXNX-NSHDSACASA-N 289.291 2.224 5 50 CEBA CN(Cc1cscn1)C(=O)c1cccc([N+](=O)[O-])c1O 123207239 HRVQDAPUENFGBG-UHFFFAOYSA-N 293.304 2.029 5 50 CEBA COc1ccc(CNc2cc([N+](=O)[O-])c(C)c[n+]2[O-])cc1 526916857 NEUPJFPWRNCEDC-UHFFFAOYSA-N 289.291 2.157 5 50 CEBA C[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1nn(C)cc1O 1615003095 DDHAQANZYNPVRF-ZETCQYMHSA-N 280.259 2.346 5 50 CEBA O=[N+]([O-])c1ccc([C@H](O)CNCc2ccccc2)cc1 19301145 JDCPMOWSBPLTHF-OAHLLOKOSA-N 272.304 2.418 5 50 CEBA O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@H](O)C2)c1 241398 VOVWXRBCGOSETA-NSHDSACASA-N 270.716 2.205 5 50 CEBA CCOC(=O)COc1cc([N+](=O)[O-])c(F)cc1Cl 167399 AJRWCBHDUPHUML-UHFFFAOYSA-N 277.635 2.329 5 50 CEBA O=[N+]([O-])c1ccc(OC[C@@H](O)CNc2ccccc2)cc1 5090729 ZHSMCWBQWSHBJI-AWEZNQCLSA-N 288.303 2.447 5 50 CEBA Cc1nnc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])s1 464422 LBYMBJFUQKLOQB-VOTSOKGWSA-N 290.304 2.407 5 50 CEBA O/N=c1\c2c3ccccc3/c(=N\O)c=2c2ccccc12 25667937 NJXFSCLZEPHNQZ-JRDMOELTSA-N 262.268 2.173 5 50 CEBA COc1ccc([N+](=O)[O-])cc1I 339012 KBQBNJHOTNIGDD-UHFFFAOYSA-N 279.033 2.208 5 50 CEBA in-vitro Cc1ccc([N+](=O)[O-])c(Oc2nc(C)nc(N(C)C)n2)c1 489503937 ZRIQGLGRJMLXTP-UHFFFAOYSA-N 289.295 2.255 5 50 CEBA COC(=O)c1ccc(NC2CCC2)c([N+](=O)[O-])c1 145773717 VKVXKLRSPIVATP-UHFFFAOYSA-N 250.254 2.346 5 50 CEBA COC(=O)c1cc(F)c(Br)cc1[N+](=O)[O-] 91692986 HPMNCYDJGIMYKN-UHFFFAOYSA-N 278.033 2.283 5 50 CEBA O=[N+]([O-])c1nc(Br)cc(Br)c1O 91301674 PAOUQXQZTIDFPZ-UHFFFAOYSA-N 297.890 2.220 5 50 CEBA in-vitro COc1nc(C)c([N+](=O)[O-])c(N(C)c2ccccc2)n1 4006011 YMAGEBHXAYLGLF-UHFFFAOYSA-N 274.280 2.470 5 50 CEBA CCOC(=O)CSc1nc2cc([N+](=O)[O-])ccc2[nH]1 6693750 UFDNLHGALVJTHI-UHFFFAOYSA-N 281.293 2.126 5 50 CEBA CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F 95495692 GAIJSHXMSSLUTC-UHFFFAOYSA-N 283.227 2.407 5 50 CEBA O=[N+]([O-])c1ccc(Cc2ccccn2)c([N+](=O)[O-])c1 4086682 KKFNJVINGIUTIH-UHFFFAOYSA-N 259.221 2.489 5 50 CEBA Cc1cc(C(=O)N[C@]2(C)CCCOC2)ccc1[N+](=O)[O-] 330655513 MUKIYHYVVGASKJ-CQSZACIVSA-N 278.308 2.202 5 50 CEBA CCOC(=O)NC/C=C\c1cccc([N+](=O)[O-])c1 4530152 KKFXAXGAVXDGKR-XQRVVYSFSA-N 250.254 2.354 5 50 CEBA COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])o2)cc1 183135 UZCSGUXZTYSOQS-UHFFFAOYSA-N 276.248 2.126 5 50 CEBA COc1ccc([N+](=O)[O-])c(Br)c1[N+](=O)[O-] 169724866 FPDNCAVWOUOBNQ-UHFFFAOYSA-N 277.030 2.274 5 50 CEBA in-vitro COC(=O)c1cc(N)c(C(C)(C)C)c([N+](=O)[O-])c1 3080859 CFKCLNSBUNWXLX-UHFFFAOYSA-N 252.270 2.261 5 50 CEBA COc1ccc(/C=C2/[C@H](O)C3CCN2CC3)cc1[N+](=O)[O-] 4832206 LAZPCIJLAUPZMJ-UZGISAJGSA-N 290.319 2.031 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N[C@@H]2c3ccccc3C[C@@H]2O)c1 192783034 LMNHQNQJPZWYFW-LSDHHAIUSA-N 285.303 2.247 5 50 CEBA CCc1ncc(CNc2ccc([N+](=O)[O-])c(C)n2)[nH]1 1651460375 LZTNVEPZRGIBTO-UHFFFAOYSA-N 261.285 2.196 5 50 CEBA O=[N+]([O-])c1cnc(Oc2ccc(-n3cncn3)cc2)s1 253425006 NORRHMMQKWOIAC-UHFFFAOYSA-N 289.276 2.424 5 50 CEBA C[C@@H](CC[N+](C)(C)C)OC(=O)[C@H]1OCCc2ccccc21 220132760 VCKFCODGNHIGOS-BBRMVZONSA-N 292.399 2.328 5 50 CEBA O=Cc1c(F)c(Br)cc([N+](=O)[O-])c1F 1857784411 WAUHXUZIPPGMQO-UHFFFAOYSA-N 265.997 2.448 5 50 CEBA Cc1ccc([N+](=O)[O-])c(C(=O)O)c1Br 216701311 QURYIYPDFSCTCX-UHFFFAOYSA-N 260.043 2.364 5 50 CEBA COC(=O)CCc1c([N+](C)(C)C)[nH]c2ccccc12 409977 MZYQZBNAESZOKV-UHFFFAOYSA-N 261.345 2.470 5 50 CEBA C[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 4677181 XZAAEPTZJMPZTJ-LHXDFBSTSA-N 290.319 2.244 5 50 CEBA CC(=O)N1c2ccc([N+](=O)[O-])cc2N(C(C)=O)[C@H](C)[C@H]1C 4769766 PMTHDUKCVRFGKD-RKDXNWHRSA-N 291.307 2.091 5 50 CEBA O=C1C[C@H](CNc2cccc(F)c2[N+](=O)[O-])CN1C1CC1 253423950 SRUPWKMSNPMJDS-SECBINFHSA-N 293.298 2.157 5 50 CEBA C[C@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C[C@@H](C)O1 12465149 DUUITWYJLMWWKB-GRPTYIHUSA-N 290.319 2.244 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2ccc(Br)cc2)N1 221451 VYMIHEBRKGBIJG-ONGXEEELSA-N 299.124 2.046 5 50 CEBA O=[N+]([O-])c1ccc(N2CCCC2)cc1N1CCOCC1 3877921 FJFSLLRMCMMHKS-UHFFFAOYSA-N 277.324 2.032 5 50 CEBA CCC[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C1CCC1 413448214 JEPYSHSRJCBAOB-NSHDSACASA-N 292.339 2.469 5 50 CEBA O=[N+]([O-])/C(=C/NCc1ccccc1)c1cc(O)ccc1O 333865 NPSRMRWMLLJDIC-GXDHUFHOSA-N 286.287 2.463 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2cccc3ccccc23)N1 105432 VSTQRSGTVPVEOS-UKRRQHHQSA-N 270.288 2.436 5 50 CEBA O=[N+]([O-])c1cccc(-c2nnnn2-c2ccccc2)c1 229966 OUINNTXQGDNUKS-UHFFFAOYSA-N 267.248 2.238 5 50 CEBA COc1cc(Br)c([N+](=O)[O-])cc1[N+](=O)[O-] 3013288 SYWWRIKZBWQUGY-UHFFFAOYSA-N 277.030 2.274 5 50 CEBA O=Cc1cccc([N+](=O)[O-])c1I 238580027 KTLAEZSJVOSWSO-UHFFFAOYSA-N 277.017 2.012 5 50 CEBA CCOC(=O)c1cc(Br)cc([N+](=O)[O-])c1O 44200593 SNQAPIZRHVIGJD-UHFFFAOYSA-N 290.069 2.240 5 50 CEBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1ccccc1 198530 GEJBNUCMDKIJRA-UHFFFAOYSA-N 282.255 2.391 5 50 CEBA O=C(CNCc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 54552061 KVTPNOGBONKBOL-UHFFFAOYSA-N 285.303 2.323 5 50 CEBA C[C@@H](C(=O)Nc1ccc(Cl)cn1)n1cc([N+](=O)[O-])cn1 1421984 RCDORMIBWFKNCS-ZETCQYMHSA-N 295.686 2.039 5 50 CEBA Cc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cn2)cc1 4877604 NRJYXDGOFKYSCZ-UHFFFAOYSA-N 293.304 2.099 5 50 CEBA CCN(c1cccc(C)c1)c1ncnc(N)c1[N+](=O)[O-] 3912619 WETAOAWNURLXTE-UHFFFAOYSA-N 273.296 2.433 5 50 CEBA O=C1N[C@H](c2cccc([N+](=O)[O-])c2)Oc2ccccc21 344926 XCTIHFILMXCQSS-AWEZNQCLSA-N 270.244 2.416 5 50 CEBA O=C(O)c1cc([N+](=O)[O-])c(F)cc1Br 35333685 APETYHSLTIVOQX-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA Cc1cn([C@H]2CCCc3cccnc32)nc1[N+](=O)[O-] 1875279036 VEUXGJJQCYVEHT-NSHDSACASA-N 258.281 2.420 5 50 CEBA C[C@H]1Cc2ccccc2N1c1ncnc(N)c1[N+](=O)[O-] 4059602 IQECUWFFIFFPBO-QMMMGPOBSA-N 271.280 2.050 5 50 CEBA Cc1ccc(OCCN2C[C@@H](C)O[C@H](C)C2)c([N+](=O)[O-])c1 20167793 LPQPPEMRNGDHPA-CHWSQXEVSA-N 294.351 2.391 5 50 CEBA CCc1ccccc1Nc1ncnc(N)c1[N+](=O)[O-] 3912548 APNZQRYZKNDUJI-UHFFFAOYSA-N 259.269 2.273 5 50 CEBA Cc1cc(N[C@@H](CCC(C)(C)C)C(N)=O)ncc1[N+](=O)[O-] 225605036 NTNDTLRYLQWNEZ-JTQLQIEISA-N 294.355 2.390 5 50 CEBA O=Cc1ccc(N2CCC(F)(F)C2)cc1[N+](=O)[O-] 169725291 TVTOKYXZOXERDJ-UHFFFAOYSA-N 256.208 2.253 5 50 CEBA O=[N+]([O-])c1cccc(OCCOCCN2CCCCC2)c1 4841863 JVAIWXWCQFVKCZ-UHFFFAOYSA-N 294.351 2.476 5 50 CEBA CC(C)N1C[C@H]2C[C@H]1CN2c1ccc([N+](=O)[O-])cc1 245189260 IALOKGJESNPPFT-UONOGXRCSA-N 261.325 2.266 5 50 CEBA O=[N+]([O-])c1cccnc1N1CC[C@@H](c2ccncc2)C1 585092091 DVLXTOCPJXRBQW-GFCCVEGCSA-N 270.292 2.379 5 50 CEBA O=C(O)c1cc([N+](=O)[O-])c(Br)s1 1226985 NTICRYSYQVALQQ-UHFFFAOYSA-N 252.045 2.117 5 50 CEBA Cc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1[N+](=O)[O-] 4020713 WWZLBFAFCHQFSE-UHFFFAOYSA-N 298.364 2.324 5 50 CEBA CCOP(=O)(Cc1cn(C)nc1[N+](=O)[O-])OCC 1776003950 GPEVLWIMXNLHQF-UHFFFAOYSA-N 277.217 2.094 5 50 CEBA CCO[P@](=O)(O)COc1ccc([N+](=O)[O-])cc1 2899959 WWRCWDUOKYQAMJ-UHFFFAOYSA-N 261.170 2.153 5 50 CEBA Cc1cc(NCc2c(C)n[nH]c2C)ncc1[N+](=O)[O-] 301433812 LEBXYTPMZZAGIB-UHFFFAOYSA-N 261.285 2.250 5 50 CEBA CC(=O)Nc1c(Br)cccc1[N+](=O)[O-] 4087004 MBAPRVODHSSHJA-UHFFFAOYSA-N 259.059 2.316 5 50 CEBA COC[C@@H]1CCCN(c2ccc(N)cc2[N+](=O)[O-])C1 225820439 BCOJSWVDRMUTNH-SNVBAGLBSA-N 265.313 2.040 5 50 CEBA CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br 95218042 IRRXRYZVBOHGKP-UHFFFAOYSA-N 294.126 2.151 5 50 CEBA in-vitro C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 16514120 GGHVLSZFXJPAPS-PHIMTYICSA-N 250.298 2.204 5 50 CEBA COC[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Cl 2856544 UVGPSAXDGUQXQO-ZETCQYMHSA-N 272.688 2.013 5 50 CEBA COC(=O)Cc1cc(C(F)(F)F)ccc1[N+](=O)[O-] 97757332 HTYXDFJLXVWTBN-UHFFFAOYSA-N 263.171 2.329 5 50 CEBA CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 3885888 GRMROGBILXDRPV-UHFFFAOYSA-N 298.242 2.320 5 50 CEBA in-vitro CCOCCCNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 2821657 PPXMJRHCKOQHJF-UHFFFAOYSA-N 286.715 2.405 5 50 CEBA O=c1c([N+](=O)[O-])c[nH]c2c(OCC(F)(F)F)cccc12 1772716075 NLCFAYUQARJDBE-UHFFFAOYSA-N 288.181 2.377 5 50 CEBA COCCCNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 2874918 ZIXIPDBQFXHHKJ-UHFFFAOYSA-N 272.688 2.015 5 50 CEBA CN(C)[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C12CCC2 585118034 VBEWEWPLHWPEJD-VXGBXAGGSA-N 276.340 2.275 5 50 CEBA CCCN1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 5062921 BSKNOVIEKUATMM-UHFFFAOYSA-N 292.339 2.154 5 50 CEBA O=[N+]([O-])c1ccc(O)c(NCn2nnc3ccccc32)c1 19201909 WSHIYGKRSZUBFT-UHFFFAOYSA-N 285.263 2.115 5 50 CEBA CN1CCC(N(C)Cc2ccc([N+](=O)[O-])s2)CC1 237437 QDJOLERLCKXRLH-UHFFFAOYSA-N 269.370 2.182 5 50 CEBA COC(C)(C)C[C@H](C)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 119062088 XVFZQSCYBHRDOQ-VIFPVBQESA-N 296.323 2.234 5 50 CEBA CCCCOc1ccccc1[C@@H]1NC(=O)CC[C@H]1[N+](=O)[O-] 4152259 ATMZHVLDKMDMSD-DOMZBBRYSA-N 292.335 2.462 5 50 CEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1O 4695712 VJLGNQXAFOBHJH-UHFFFAOYSA-N 288.259 2.318 5 50 CEBA COC(=O)[C@H]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(OC)c2)C1 279178605 VKOFPFRGVANPDO-VHSXEESVSA-N 294.307 2.357 5 50 CEBA C[N+](C)(C)C1[C@@H]2CC[C@@H]3C2C2[C@H]1CC[C@H]2C3[N+](C)(C)C 257356191 GRVSLICFPDXWRA-HEVBAVJNSA-N 278.484 2.448 5 50 CEBA CC(=O)n1ncc2cc(Br)c([N+](=O)[O-])cc21 675050781 XYGZWACSHKNKRH-UHFFFAOYSA-N 284.069 2.367 5 50 CEBA Cc1ccnc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)n1 194675383 WKOUXSVYLDOXDF-UHFFFAOYSA-N 286.291 2.183 5 50 CEBA O=C(NC[C@@H]1CCCOC1)c1cccc([N+](=O)[O-])c1Cl 160401259 RPOZFLILNHSDBG-VIFPVBQESA-N 298.726 2.405 5 50 CEBA O=C(Nc1cc([N+](=O)[O-])ccc1C(=O)O)c1ccco1 89134 FZOXKJHNZLFFKL-UHFFFAOYSA-N 276.204 2.138 5 50 CEBA COc1ccc(C(=O)Nc2nnc(C)s2)cc1[N+](=O)[O-] 175650 MWPYRIRCXSMRDN-UHFFFAOYSA-N 294.292 2.016 5 50 CEBA CCOC(=O)Cn1cncc1-c1ccc([N+](=O)[O-])cc1 301681 FJORANAZWVMHEH-UHFFFAOYSA-N 275.264 2.021 5 50 CEBA COC(=O)c1ccc(-c2ccc([N+](=O)[O-])cn2)cc1 3883865 XRRFJUHQTAZVKU-UHFFFAOYSA-N 258.233 2.443 5 50 CEBA Cc1c([N+](=O)[O-])ccc(Br)c1C(=O)O 138344819 XQABXCWLMRTEQI-UHFFFAOYSA-N 260.043 2.364 5 50 CEBA O=[N+]([O-])c1ccccc1CN1CCCC[C@H]1CCO 16513794 DNQFUKZVUDSZMN-ZDUSSCGKSA-N 264.325 2.332 5 50 CEBA CCOC(=O)C[C@H](C[N+](=O)[O-])c1ccccc1OC 35287637 XWJLFKQKXXOWHQ-SNVBAGLBSA-N 267.281 2.009 5 50 CEBA O=[N+]([O-])c1cnc(Nc2cnn(CC(F)F)c2)s1 192457451 QDECEUSAPRETJH-UHFFFAOYSA-N 275.240 2.257 5 50 CEBA Cc1ccnc(N2CC[C@H](CCN(C)C)C2)c1[N+](=O)[O-] 904217387 CDXGBIAJUYCKHG-LBPRGKRZSA-N 278.356 2.076 5 50 CEBA COc1ccc([N+](=O)[O-])c(NC2CCN(C)CC2)c1 155802043 OAJPUQOLMDIBME-UHFFFAOYSA-N 265.313 2.110 5 50 CEBA C[C@H](Nc1ncc([N+](=O)[O-])s1)c1nnc2n1CCCC2 192493497 VZVAVDQZJIIFKU-ZETCQYMHSA-N 294.340 2.152 5 50 CEBA Cc1ccnc(NCc2cn(C3CCC3)nn2)c1[N+](=O)[O-] 585092370 STOJWTDFYNVKTJ-UHFFFAOYSA-N 288.311 2.227 5 50 CEBA Cc1ccc(Nc2ncnc(N)c2[N+](=O)[O-])cc1C 3912580 QNCHGIOLMBWYBW-UHFFFAOYSA-N 259.269 2.327 5 50 CEBA O=C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 113367822 LKKUBECGUXCFGH-UHFFFAOYSA-N 256.208 2.042 5 50 CEBA Nc1cccc([C@H](C[N+](=O)[O-])O[C@@H]2CCCCO2)c1 72446985 YYTFIBZARMMTFA-QWHCGFSZSA-N 266.297 2.130 5 50 CEBA Cc1cccc(NC(=O)c2nn(C)c(C)c2[N+](=O)[O-])c1 370963 WKYALQFCJPTYIS-UHFFFAOYSA-N 274.280 2.197 5 50 CEBA C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ncc[nH]1 141322420 CESFTCJCUQJNOD-MRVPVSSYSA-N 275.268 2.201 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2ccc(C(F)(F)F)cc2)N1 115981 LJCIZWPTTFFJTB-ONGXEEELSA-N 288.225 2.302 5 50 CEBA O=C(O)Cn1c2ccccc2c(=O)c2ccccc21 3878688 UOMKBIIXHQIERR-UHFFFAOYSA-N 253.257 2.239 5 50 CEBA biogenic,in-man O=C(O)c1cc([N+](=O)[O-])ccc1OC(F)(F)F 95644322 KKHGLYHYTVNDAE-UHFFFAOYSA-N 251.116 2.192 5 50 CEBA Nc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 225979 WMBQAJRNBQWSPS-UHFFFAOYSA-N 257.249 2.429 5 50 CEBA Cc1cnc(N2CCO[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 230145341 NWTMJIUPRKIZCO-YPMHNXCESA-N 277.324 2.446 5 50 CEBA CN(CCOC(=O)c1cccc([N+](=O)[O-])c1)C(C)(C)C 2927578 BFQZTDVVCWZWIF-UHFFFAOYSA-N 280.324 2.482 5 50 CEBA Nc1c2c(nc3ccc([N+](=O)[O-])cc13)CCCC2=O 4955390 NGGNNYCJIOMJBD-UHFFFAOYSA-N 257.249 2.244 5 50 CEBA Cc1c([N+](=O)[O-])cc(C(=O)NC(C)(C)C)cc1[N+](=O)[O-] 2831431 OIRGUOKAXVUREX-UHFFFAOYSA-N 281.268 2.340 5 50 CEBA biogenic CCN1CCCN(c2ccc([N+](=O)[O-])c(C)n2)[C@@H](C)C1 408523764 NAAYGBMAEVKXHR-NSHDSACASA-N 278.356 2.219 5 50 CEBA COc1c(N)cc(F)c([N+](=O)[O-])c1Br 675050638 NLNFZUVHYNGFMB-UHFFFAOYSA-N 265.038 2.087 5 50 CEBA NC(=O)c1cc([N+](=O)[O-])ccc1NCCc1ccccc1 5063495 KHDPULIHDUWGNK-UHFFFAOYSA-N 285.303 2.348 5 50 CEBA COC(=O)c1cc(=O)c2ccc3c(N)cccc3c2[nH]1 71772797 OZFSJZYIOFCGBS-UHFFFAOYSA-N 268.272 2.050 5 50 CEBA CN(C)C(=O)COc1ccc2c(c1)oc(=O)c1ccccc12 83585 UMGRLHMRKGBXPO-UHFFFAOYSA-N 297.310 2.413 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccccc2)cc1 121153 BJKNXDSKYOQVTJ-UHFFFAOYSA-N 278.289 2.396 5 50 CEBA in-vitro CC(=O)c1ccc(N2CC[C@H](N(C)C)[C@@H]2C)c([N+](=O)[O-])c1 314851713 DPRRXNHTHZAVNC-GWCFXTLKSA-N 291.351 2.326 5 50 CEBA Cc1ccc([C@H]2CC[N+]3(CCS(=O)(=O)CC3)C2)c(C)c1 1615610995 SYXMQCRMSHQNNH-HNNXBMFYSA-N 294.440 2.036 5 50 CEBA O=C(Nc1ccncc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3153944 NAILWVPUOVJVNG-UHFFFAOYSA-N 288.219 2.150 5 50 CEBA Nc1ccc(Cc2ccc(N)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 3882150 WJLPZRZKWVPCMN-UHFFFAOYSA-N 288.263 2.258 5 50 CEBA CC(=O)c1ccc(N2CC[C@@](C)(N(C)C)C2)c([N+](=O)[O-])c1 1615588608 CHTVOYNNRULIPQ-OAHLLOKOSA-N 291.351 2.328 5 50 CEBA Nc1nc(N2CCc3ccccc32)ccc1[N+](=O)[O-] 167782366 RWQIILXDAGZWTR-UHFFFAOYSA-N 256.265 2.266 5 50 CEBA Cc1ccnc(NCC(=O)OC(C)(C)C)c1[N+](=O)[O-] 301307361 ZWBGAAPCIOCWBN-UHFFFAOYSA-N 267.285 2.052 5 50 CEBA Cn1cnnc1Sc1ccc([N+](=O)[O-])c2cccnc12 310666 RMYCZXRLBFQOFF-UHFFFAOYSA-N 287.304 2.423 5 50 CEBA Cc1ccc(S(=O)(=O)Nc2nccs2)cc1[N+](=O)[O-] 3832982 RIBQHFLANJJMSC-UHFFFAOYSA-N 299.333 2.161 5 50 CEBA O=C(OCc1ccccc1)N1CCC[C@H]([N+](=O)[O-])CC1 96032010 HMGKXDJEYOSFMV-ZDUSSCGKSA-N 278.308 2.454 5 50 CEBA CC(C)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517306 AYLCDVYHZOZQKM-JTQLQIEISA-N 283.240 2.024 5 50 CEBA in-vitro Cc1nc([N+](=O)[O-])cn1CCC(=O)OCC1(C)CC(C)C1 1875287512 MLBWNUVUHDRUOM-UHFFFAOYSA-N 295.339 2.469 5 50 CEBA Cc1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])o2)cc1 1860216 GAUHIPWCDXOLCZ-UHFFFAOYSA-N 267.262 2.329 5 50 CEBA in-vitro COc1cc([N+](=O)[O-])ccc1NC(=O)n1cc(C)cn1 5060926 LNPPDKCZXXLDEJ-UHFFFAOYSA-N 276.252 2.189 5 50 CEBA O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccccc1 3958842 DQMWYNBADRINBR-UHFFFAOYSA-N 286.287 2.290 5 50 CEBA Cc1cc(C(=O)N[C@@H](C)[C@@H]2CCCO2)ccc1[N+](=O)[O-] 1056289 UQFFUXZXOBEKGG-GWCFXTLKSA-N 278.308 2.201 5 50 CEBA Cc1cc(C(=O)O)cc([N+](=O)[O-])c1Br 132084048 WYNYRBQJISZOGZ-UHFFFAOYSA-N 260.043 2.364 5 50 CEBA C[C@H](CC[N+](C)(C)C)OC(=O)[C@H]1OCCc2ccccc21 220132835 VCKFCODGNHIGOS-CJNGLKHVSA-N 292.399 2.328 5 50 CEBA O=C1CCCc2c1nc(-c1cccc([N+](=O)[O-])c1)n2O 300129 IFUVWDRHFBIXHZ-UHFFFAOYSA-N 273.248 2.215 5 50 CEBA CS[C@@H](CO)[C@H](C)Nc1ccc([N+](=O)[O-])c(C(C)=O)c1 239653800 BLKDTGSSUPXNDP-SDBXPKJASA-N 298.364 2.322 5 50 CEBA CCN(CC)CCOCCOc1ccccc1[N+](=O)[O-] 2895221 VKUNCSYLBWDVAB-UHFFFAOYSA-N 282.340 2.332 5 50 CEBA CCOC(=O)[C@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 4978097 FQLARNHBJUNWLM-ZDUSSCGKSA-N 292.335 2.370 5 50 CEBA O=C(COc1ccc([N+](=O)[O-])cc1)NC1CCCC1 137108 CUCHOAKKKQGOCS-UHFFFAOYSA-N 264.281 2.032 5 50 CEBA CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C 3877905 RYQKAFQKGCZPFR-SECBINFHSA-N 297.742 2.305 5 50 CEBA Cc1ccc(S(=O)(=O)c2ncccc2[N+](=O)[O-])cc1 1406496 RQVPHAQDHVQDAD-UHFFFAOYSA-N 278.289 2.131 5 50 CEBA O=C(O)c1nn(C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 5749130 KSPSQGXCQMJFKD-UHFFFAOYSA-N 291.307 2.415 5 50 CEBA Cc1ccc(NC(=O)[C@H]2CCCO2)cc1[N+](=O)[O-] 474759 UPFPUBPSJQCXFH-LLVKDONJSA-N 250.254 2.021 5 50 CEBA Cc1nc([C@@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2)no1 225836827 WXVVMOVBJQTKSM-SSDOTTSWSA-N 291.267 2.169 5 50 CEBA COC(=O)CCSc1ccc(C(=O)OC)cc1[N+](=O)[O-] 127396 XYRFGRPUSVXKBF-UHFFFAOYSA-N 299.304 2.037 5 50 CEBA O=C(O)c1ccc(NCc2cccnc2)c([N+](=O)[O-])c1 4183291 XISBJMWNSNWBAT-UHFFFAOYSA-N 273.248 2.300 5 50 CEBA O=[N+]([O-])c1ccc(N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)nc1 601252599 NWDPTNKAISWRJG-AGIUHOORSA-N 277.324 2.120 5 50 CEBA O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCSC1 279607350 QHRZKIIZKXGZLU-NSHDSACASA-N 280.349 2.007 5 50 CEBA Nc1cc(Cl)c(I)cc1[N+](=O)[O-] 85221118 KWHURWOGZQWLTK-UHFFFAOYSA-N 298.467 2.435 5 50 CEBA in-vitro COC(=O)Cc1cc(Br)ccc1[N+](=O)[O-] 71609354 MIXSLFKHFLGMNS-UHFFFAOYSA-N 274.070 2.073 5 50 CEBA O=[N+]([O-])c1cc(Br)cc(C2OCCO2)c1 237986085 HJDQZMGUPYCUSP-UHFFFAOYSA-N 274.070 2.403 5 50 CEBA O=C(O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 3866252 DBPSLLDEGNZGLQ-UHFFFAOYSA-N 264.159 2.110 5 50 CEBA in-vitro CC(C)(O)CC(=O)Nc1nccc2c([N+](=O)[O-])cccc12 863947728 CDUTWVMUIKCUFN-UHFFFAOYSA-N 289.291 2.243 5 50 CEBA CC[C@@H](CO)Nc1ccc([N+](=O)[O-])c2cccnc12 4046651 YKCYNBVEMRCWRC-VIFPVBQESA-N 261.281 2.326 5 50 CEBA C[C@@H](CC(=O)O)CC(=O)Nc1ccc([N+](=O)[O-])cc1 4949463 NQKYLOKLAHZQHV-MRVPVSSYSA-N 266.253 2.034 5 50 CEBA CC(C)Oc1ccccc1[C@@H]1NC(=O)CC[C@H]1[N+](=O)[O-] 90381 GZKUGDIHWJPWNL-RISCZKNCSA-N 278.308 2.070 5 50 CEBA CCn1cc(CNC(=O)c2cccc([N+](=O)[O-])c2)c(C)n1 372997 QQYLNDYGEFTTSJ-UHFFFAOYSA-N 288.307 2.050 5 50 CEBA Cc1c(C(=O)N2CCOc3ccncc32)cccc1[N+](=O)[O-] 174925647 BTZMZUBXGQUNFE-UHFFFAOYSA-N 299.286 2.337 5 50 CEBA O=[N+]([O-])c1cnc(NC2CSC2)c(Br)c1 585118003 PQJNUVPERHTTEU-UHFFFAOYSA-N 290.142 2.280 5 50 CEBA O=c1c(Cl)c(Cl)cnn1-c1ccc([N+](=O)[O-])cc1 300476 QARILIFILZKMIE-UHFFFAOYSA-N 286.074 2.448 5 50 CEBA C[C@@H](NC(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1)c1ccccc1 1423693 PVBFQRCGAKXSAU-GHMZBOCLSA-N 288.307 2.230 5 50 CEBA CO[C@@H]1CN(c2cc(N)ccc2[N+](=O)[O-])CC[C@@H]1C 249292509 PZSMCUDMKBDLPW-TVQRCGJNSA-N 265.313 2.038 5 50 CEBA O=C(Cc1ccc(F)cc1)Nc1ncc([N+](=O)[O-])s1 4599381 FKVULPHUKXJMJG-UHFFFAOYSA-N 281.268 2.372 5 50 CEBA C[C@H]1CN(c2ccc([N+](=O)[O-])c(Cl)n2)C[C@@H](C)O1 220972095 IQAPYMRQSUJETN-OCAPTIKFSA-N 271.704 2.257 5 50 CEBA O=[N+]([O-])c1ccc(CCNC[C@H](O)c2ccccc2)cc1 35677774 GXTZAIGFWQRDSQ-INIZCTEOSA-N 286.331 2.461 5 50 CEBA in-vitro O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CCc1ccccc1 2890228 FJQDQDYABDRENR-UHFFFAOYSA-N 296.282 2.434 5 50 CEBA O=[N+]([O-])c1ccc(N2CCOC[C@@H]2Cc2ccccc2)nc1 426879029 NWXHMLIYKSUCBI-HNNXBMFYSA-N 299.330 2.438 5 50 CEBA Cn1c(CO)cnc1SCc1ccc([N+](=O)[O-])cc1 4003042 MRUNTRWMLDDKJN-UHFFFAOYSA-N 279.321 2.113 5 50 CEBA C[n+]1cccc(CC[C@H]2Nc3ccc([N+](=O)[O-])cc3N2)c1 5570454 VATVRKZESPWJAU-HNNXBMFYSA-N 285.327 2.216 5 50 CEBA CCN1CCN(CCCOc2ccccc2[N+](=O)[O-])CC1 2862654 FJJMLGGPFMKWKC-UHFFFAOYSA-N 293.367 2.001 5 50 CEBA O=c1[nH]nc(CNc2ccc([N+](=O)[O-])cc2)c2ccccc12 4002768 LNMGMZDMSIWUJT-UHFFFAOYSA-N 296.286 2.443 5 50 CEBA COc1cc2c(cc1OC)[C@H](C)[N@@+](C)(C[C@H](C)O)CC2 252441045 CDGPCRFXVCWTDY-NVGCLXPQSA-N 280.388 2.148 5 50 CEBA biogenic Cc1ccnc(NC2CC(O)(C(F)(F)F)C2)c1[N+](=O)[O-] 952881147 FVGAYVRAVKBEIR-UHFFFAOYSA-N 291.229 2.166 5 50 CEBA CCN1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 4819906 JZYVIDLHOPKODG-UHFFFAOYSA-N 297.742 2.026 5 50 CEBA O=C(C[C@@H]1CCCCO1)Nc1ccc(O)c([N+](=O)[O-])c1 166101526 YQLTWFPCAOBEIT-JTQLQIEISA-N 280.280 2.198 5 50 CEBA Cc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] 4611143 PCGFEOXSDDGDMG-UHFFFAOYSA-N 284.337 2.078 5 50 CEBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1[C@H]1C[C@H]2CC[C@H]1C2 101589143 IKFDTAHCCFDZSJ-RVBZMBCESA-N 286.287 2.379 5 50 CEBA C[C@@H]1CCNC(=O)[C@H]1Nc1ccc(Cl)cc1[N+](=O)[O-] 193519398 QABJXSMURHCCII-HQJQHLMTSA-N 283.715 2.185 5 50 CEBA COc1ccc(C(=O)Nc2nccs2)cc1[N+](=O)[O-] 180946 DMTWAZJHBSUIKC-UHFFFAOYSA-N 279.277 2.312 5 50 CEBA C[C@H]1CCCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-] 333747 LCTNFWXTMUHRBV-JTQLQIEISA-N 284.337 2.158 5 50 CEBA Cc1cc(C(=O)N2CCC[C@@H]([C@H](C)N)C2)cc([N+](=O)[O-])c1 135237308 SXHCEVOZEOEIIK-NWDGAFQWSA-N 291.351 2.103 5 50 CEBA Cc1ccc(NC(=S)NC[C@H]2CCCO2)c([N+](=O)[O-])c1 5041673 VHLLXHBNDVFGEB-SNVBAGLBSA-N 295.364 2.369 5 50 CEBA Cc1ccc([N+](=O)[O-])cc1NC(=S)NC[C@@H]1CCCO1 5062861 LWLFBYMWTSWMNI-NSHDSACASA-N 295.364 2.369 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H](O)C1 4988826 ZPHKJRKWWFKLKH-VUUYWXRKSA-N 262.309 2.065 5 50 CEBA NC(=O)c1ccc(NC2CCCCC2)c([N+](=O)[O-])c1 4755305 NZTUSCIOJRINPQ-UHFFFAOYSA-N 263.297 2.438 5 50 CEBA Cc1n[nH]c(Nc2ccc(C(=O)O)cc2)c1[N+](=O)[O-] 3998419 MPKIAABIBUVPSF-UHFFFAOYSA-N 262.225 2.068 5 50 CEBA CC[N@@+]12CCC[C@H]3[C@@H]4CCCC(=O)N4C[C@@H](CCC1)[C@@H]32 252441085 FFXCRHHKJZTONF-BTWZCHHXSA-N 277.432 2.406 5 50 CEBA biogenic O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2CCO)cc1 4947934 CITTVJTYGPEOFC-CYBMUJFWSA-N 264.325 2.332 5 50 CEBA Nc1ncnc(NC2C3CC4CC(C3)CC2C4)c1[N+](=O)[O-] 170621890 HQVXUOSIZZTRPV-UHFFFAOYSA-N 289.339 2.204 5 50 CEBA Cc1cc([N+](=O)[O-])c(N2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 4054653 NNDMGZJKWCOVPF-UWVGGRQHSA-N 295.295 2.425 5 50 CEBA Cc1cc(C(=O)NCc2ccncc2)ccc1[N+](=O)[O-] 435777 RUZIYSKEKKOUEB-UHFFFAOYSA-N 271.276 2.228 5 50 CEBA O=[N+]([O-])c1ccc(NCCNCc2cccnc2)cc1 4624184 UIAXTIGVHWROFO-UHFFFAOYSA-N 272.308 2.192 5 50 CEBA C[C@H](CC(=O)O)CC(=O)Nc1ccc([N+](=O)[O-])cc1 4949462 NQKYLOKLAHZQHV-QMMMGPOBSA-N 266.253 2.034 5 50 CEBA N[C@@H]1CC[C@H]2CN(Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@@H]12 221870487 FQXVZVWNLNTZOY-DMDPSCGWSA-N 295.770 2.417 5 50 CEBA CCc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2)s1 96562012 SVGYDZRJUXYOOI-UHFFFAOYSA-N 278.293 2.261 5 50 CEBA CCOC(=O)/C=C(\C)Nc1cc([N+](=O)[O-])ccc1OC 5525968 QUGHSWPRFBHFLI-VQHVLOKHSA-N 280.280 2.482 5 50 CEBA CC(C)N(C(C)C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 4700003 XAZHGHKHQUDNRF-UHFFFAOYSA-N 286.353 2.402 5 50 CEBA CCOC(=O)[C@@H]1CC[C@H](Nc2cc(C)c([N+](=O)[O-])cn2)C1 280756685 MUZDSJLOQDHHNI-MNOVXSKESA-N 293.323 2.442 5 50 CEBA COc1cc2c(cc1OC)[C@H](C)[N@@+](C)(C[C@@H](C)O)CC2 252441044 CDGPCRFXVCWTDY-BWACUDIHSA-N 280.388 2.148 5 50 CEBA biogenic COC(=O)c1cc(Br)cc([N+](=O)[O-])c1C 14909845 UPBDNPCJIJAMPI-UHFFFAOYSA-N 274.070 2.452 5 50 CEBA O=[N+]([O-])c1ccc(N2CCCC2)cc1SCCO 4044513 YTGBORIPVDEOJS-UHFFFAOYSA-N 268.338 2.279 5 50 CEBA CCN(C)C[C@H]1CCN(c2cc(OC)ccc2[N+](=O)[O-])C1 170652509 RBHICTVFFWXDJL-GFCCVEGCSA-N 293.367 2.381 5 50 CEBA CC[C@H]1CO[C@H](CC)CN1c1ncccc1[N+](=O)[O-] 585090433 MVDDTETXMGOLIJ-WDEREUQCSA-N 265.313 2.384 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2ccccc2Br)N1 90363 AWZHFUMNBBNKNS-GXSJLCMTSA-N 299.124 2.046 5 50 CEBA O=C(c1ccccc1Br)n1cc([N+](=O)[O-])cn1 37173 UINMCRJPMZIMOL-UHFFFAOYSA-N 296.080 2.242 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1cccnc1 3898300 CAABPOBWNXSXFD-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA O=[N+]([O-])c1ccccc1NS(=O)(=O)c1ccccc1 4662700 QYEQJQLZLZRQEB-UHFFFAOYSA-N 278.289 2.396 5 50 CEBA O=C(NCCCNc1ccc([N+](=O)[O-])cc1)C(F)(F)F 4706895 IIFXJAQENNZBAT-UHFFFAOYSA-N 291.229 2.075 5 50 CEBA Cc1nn([C@H](C)C(=O)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] 2776910 SSSYHYXDYDYNKC-GXSJLCMTSA-N 280.328 2.062 5 50 CEBA Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(Cl)cc1 273119 COBXECPAIMJGLI-UHFFFAOYSA-N 294.698 2.392 5 50 CEBA O=C(O)CCCNSc1ccccc1[N+](=O)[O-] 1572173 PKKSMQRFBZWDJP-UHFFFAOYSA-N 256.283 2.056 5 50 CEBA Cc1cc(OCC(=O)Nc2ccncc2)ccc1[N+](=O)[O-] 1055801 LFKFELOVNKYCMZ-UHFFFAOYSA-N 287.275 2.316 5 50 CEBA Cc1cc([N+](=O)[O-])nn1CCC(=O)NC1CCCCCC1 374586 STSNXKMBWFFZJN-UHFFFAOYSA-N 294.355 2.329 5 50 CEBA CN(C)/C=C/c1c(C=O)c2cc([N+](=O)[O-])ccc2n1C 13163090 IAGYQPKLIIOSPO-VOTSOKGWSA-N 273.292 2.431 5 50 CEBA CCC(CC)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 457197 MRGMNBFSKOGDKU-UHFFFAOYSA-N 272.326 2.062 5 50 CEBA O=C(COc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC1 613513 RYFUYXFGAVHTIV-UHFFFAOYSA-N 284.699 2.249 5 50 CEBA C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccn1 4750390 GUMANOPUSDMQEA-SNVBAGLBSA-N 287.275 2.396 5 50 CEBA C[C@H]1[C@H](C)CCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] 248470436 VCKWMKACUHPTIA-FRRDWIJNSA-N 294.351 2.065 5 50 CEBA CC[C@](C)([N+](=O)[O-])S(=O)(=O)c1ccc(C)cc1 4829197 UGFUTGQMSZWXAV-LLVKDONJSA-N 257.311 2.172 5 50 CEBA CC1=CC[C@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]2C1 100499298 QVYQESJGNYAWIR-OLZOCXBDSA-N 286.287 2.441 5 50 CEBA CC[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 3156784 QLGQUWQXUVQKCR-SSDOTTSWSA-N 281.268 2.340 5 50 CEBA biogenic O=[N+]([O-])c1ccc(N2CC[C@H](O)[C@H]3CCCC[C@H]32)nc1 601252602 NWDPTNKAISWRJG-XQQFMLRXSA-N 277.324 2.120 5 50 CEBA Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 239038405 DCXFLCFTSRNCSF-DUBDDPSESA-N 298.298 2.215 5 50 CEBA CC(C)(C)N1CN(C(C)(C)C)CC(C)([N+](=O)[O-])C1 19327455 XBARHICQDZOTFX-UHFFFAOYSA-N 257.378 2.194 5 50 CEBA O=c1c([N+](=O)[O-])c[nH]c2cc(F)c(Br)cc12 584642572 DHMXHLHFCNCMMB-UHFFFAOYSA-N 287.044 2.338 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccccc2)cc1 1728598 MVDNOADISFLEHS-UHFFFAOYSA-N 279.273 2.363 5 50 CEBA biogenic O=c1ccn(CC(F)(F)F)c2ccc([N+](=O)[O-])cc12 1772574294 FNQQZCVKCMIFDE-UHFFFAOYSA-N 272.182 2.472 5 50 CEBA Cc1nonc1O[C@H](C)CNc1ccc([N+](=O)[O-])cc1 3877926 OQWWABIXMUFBIU-MRVPVSSYSA-N 278.268 2.166 5 50 CEBA CC(C)(CO)Nc1ccc([N+](=O)[O-])c2cccnc12 4003295 XXTCKIHFVOWXPV-UHFFFAOYSA-N 261.281 2.326 5 50 CEBA C[C@@H]1CC[C@@H](NCCn2cc([N+](=O)[O-])cn2)C[C@H]1C 253370000 KWQYXLYMDNCCQQ-IJLUTSLNSA-N 266.345 2.206 5 50 CEBA O=[N+]([O-])c1c(F)cccc1N[C@H]1CC[C@H](O)CC1 252486009 CKXHBHHSQNEOGP-KYZUINATSA-N 254.261 2.449 5 50 CEBA CC(C)(C)Nc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 670417729 NMJGMJAXBAHOCW-UHFFFAOYSA-N 283.240 2.412 5 50 CEBA O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ncccn1 463570 PCFAVBFGNFWMGI-VOTSOKGWSA-N 270.248 2.037 5 50 CEBA CCN(C)[C@@H]1CCN(c2cc(F)ccc2[N+](=O)[O-])C1 241586409 OVTCWZHSQOQUPC-LLVKDONJSA-N 267.304 2.264 5 50 CEBA CC1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 47674 FQSKOBPGPSEGGS-UHFFFAOYSA-N 278.308 2.232 5 50 CEBA O=C(O)c1nc(-c2ccccc2[N+](=O)[O-])cs1 42684307 UVBAFOQPYRZYCR-UHFFFAOYSA-N 250.235 2.417 5 50 CEBA Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] 3874102 VACNDKUQVLNNLD-UHFFFAOYSA-N 251.120 2.104 5 50 CEBA CC[C@H](CO)Nc1ccc([N+](=O)[O-])c2cccnc12 4046652 YKCYNBVEMRCWRC-SECBINFHSA-N 261.281 2.326 5 50 CEBA Cc1cccc(Nc2c([N+](=O)[O-])cncc2[N+](=O)[O-])n1 4433553 LPNWSBGDTVNYHY-UHFFFAOYSA-N 275.224 2.345 5 50 CEBA CC1(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CCC1 159894910 OBZZKCXAKUWEBQ-UHFFFAOYSA-N 277.324 2.379 5 50 CEBA CCC(CC)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 457134 RMGPRSHBBZJMDG-UHFFFAOYSA-N 272.326 2.062 5 50 CEBA N[C@@H]1CC[C@@H]2CN(Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@@H]21 225363561 FQXVZVWNLNTZOY-NTZNESFSSA-N 295.770 2.417 5 50 CEBA Cn1ccc(NC(=S)Nc2cccc([N+](=O)[O-])c2)n1 612048 VILTUNMHDIOTNY-UHFFFAOYSA-N 277.309 2.137 5 50 CEBA O=C(NC1CCCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1749492 JBSBERQYYDVIMT-UHFFFAOYSA-N 279.252 2.175 5 50 CEBA CC(C)(C)C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 4688029 GSSBVCIUBNKMEB-UHFFFAOYSA-N 291.351 2.290 5 50 CEBA NC(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1 436316 MTHPAXCNLKLPNT-UHFFFAOYSA-N 258.233 2.486 5 50 CEBA O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccccc1F 4742944 VJPAZQLFAQTAEC-UHFFFAOYSA-N 299.261 2.492 5 50 CEBA CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1ccnn1 128059294 DQPVQBBJHHPUKO-UHFFFAOYSA-N 262.269 2.022 5 50 CEBA CC(C)[C@@H]1N(c2c([N+](=O)[O-])ncn2C)CC1(C)C 292879308 YSFWAGHDWXGPDQ-VIFPVBQESA-N 252.318 2.199 5 50 CEBA Cc1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1C 192499 NHCHDVPEFSIFML-UHFFFAOYSA-N 274.280 2.197 5 50 CEBA CCOC(=O)c1ncoc1-c1cccc([N+](=O)[O-])c1 15021411 UZAXALCYFMWXBH-UHFFFAOYSA-N 262.221 2.427 5 50 CEBA in-vitro CNc1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1 12358827 KKGWEPLBCABCDN-UHFFFAOYSA-O 270.381 2.475 5 50 CEBA N[C@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5127879 JXBSDLZLJPIEJN-VHSXEESVSA-N 280.284 2.185 5 50 CEBA C[C@H](CN(C)c1cnc([N+](=O)[O-])c(O)c1)c1nccs1 952993553 INSGQLRTFKNQKR-MRVPVSSYSA-N 294.336 2.392 5 50 CEBA CC(=O)c1ccc(N2CC[C@H](N(C)C)[C@H]2C)c([N+](=O)[O-])c1 314851716 DPRRXNHTHZAVNC-MFKMUULPSA-N 291.351 2.326 5 50 CEBA CC[C@@H](O)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1C 163139689 OVHXKGXRPPXLEN-LLVKDONJSA-N 281.312 2.186 5 50 CEBA O=[N+]([O-])c1cc(F)ccc1N[C@@H](CO)Cc1ccccn1 170610815 YPLYHAOISBEEAH-GFCCVEGCSA-N 291.282 2.144 5 50 CEBA Cc1cc([N+](=O)[O-])cc(NC(=O)C(F)(F)F)c1O 1776111123 OKOQLFOQUGQCJK-UHFFFAOYSA-N 264.159 2.110 5 50 CEBA Cc1cc(Nc2cc([N+](=O)[O-])ccc2C)n2ncnc2n1 83754 VHVSUUPWHABWPC-UHFFFAOYSA-N 284.279 2.393 5 50 CEBA O=Cc1cc([N+](=O)[O-])ccc1N1CCC(F)(F)C1 169725214 GBJQVQQEKBRUEA-UHFFFAOYSA-N 256.208 2.253 5 50 CEBA CC(C)Oc1ccccc1[C@H]1NC(=O)CC[C@@H]1[N+](=O)[O-] 90376 GZKUGDIHWJPWNL-SMDDNHRTSA-N 278.308 2.070 5 50 CEBA O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CCCC1 4914017 BFGGGWRYNCKJLY-UHFFFAOYSA-N 289.335 2.431 5 50 CEBA O=[N+]([O-])c1ccc(N2CCCN3CCC[C@H]3C2)cc1 247303140 FTCFPSMNLSGRMV-AWEZNQCLSA-N 261.325 2.269 5 50 CEBA Cc1nn(CCc2cncn2C)c2ccc([N+](=O)[O-])cc12 853677237 MMVWVCPONRAOSI-UHFFFAOYSA-N 285.307 2.229 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2ccc(Br)cc2)N1 221455 VYMIHEBRKGBIJG-GXSJLCMTSA-N 299.124 2.046 5 50 CEBA COC(C)(C)C[C@@H](C)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 119062188 XVFZQSCYBHRDOQ-SECBINFHSA-N 296.323 2.234 5 50 CEBA O=[N+]([O-])c1cnn([C@@H]2CCCCO2)c1Br 95704753 LGGFJFNRBLOXGF-ZETCQYMHSA-N 276.090 2.253 5 50 CEBA CC(=O)c1ccc(N2[C@H]3CC[C@H]2CC(=O)C3)c([N+](=O)[O-])c1 408524758 YVABQQBHBBZBIJ-RYUDHWBXSA-N 288.303 2.498 5 50 CEBA O=C(O)Cc1cc(Br)c([N+](=O)[O-])cc1F 169794992 AJRVYISUYCOAKA-UHFFFAOYSA-N 278.033 2.124 5 50 CEBA Cc1nc(C)c(CNc2ccc([N+](=O)[O-])c(C)n2)[nH]1 724683849 RWMGGHKMLQYCHC-UHFFFAOYSA-N 261.285 2.250 5 50 CEBA CC1(C)C[C@@H](CC(=O)Nc2ccccc2[N+](=O)[O-])C(=O)O1 4724407 VKGPSODTCVSJHR-SECBINFHSA-N 292.291 2.265 5 50 CEBA O=C(/C=C/c1ccccc1[N+](=O)[O-])NCc1ccncc1 465671 LQSCLXJPMGDDGZ-AATRIKPKSA-N 283.287 2.319 5 50 CEBA Cc1ccnc(NCc2cnc3n2CCC3)c1[N+](=O)[O-] 719801174 SCKCDHLCSPPUNM-UHFFFAOYSA-N 273.296 2.053 5 50 CEBA COC(=O)c1ccc(CSc2nc(C)[nH]c2[N+](=O)[O-])o1 308657 AMFYMRLSEPHHBQ-UHFFFAOYSA-N 297.292 2.298 5 50 CEBA COC[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1Cl 456447 QTQJCQNQFUBANR-SSDOTTSWSA-N 272.688 2.013 5 50 CEBA Cc1cc([N+](=O)[O-])cnc1NCc1nnc(CC(C)C)o1 225815292 IFPDQIWFUANBGV-UHFFFAOYSA-N 291.311 2.492 5 50 CEBA COC(=O)c1c(O)[nH]c2cc3ccccc3cc2c1=O 32919415 UNJVFWBXPFCUMS-UHFFFAOYSA-N 269.256 2.174 5 50 CEBA O=[N+]([O-])c1cnn(COc2cccc(Cl)c2)c1 2537568 IIWFQEDBHQBDFZ-UHFFFAOYSA-N 253.645 2.481 5 50 CEBA Cc1ccnc(NCc2cc3n(n2)CCC3)c1[N+](=O)[O-] 585092501 AXXQDMKYEVWSJX-UHFFFAOYSA-N 273.296 2.053 5 50 CEBA O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2nc[nH]n2)cc1 585133196 AKVAFRZHMOLCKX-LBPRGKRZSA-N 273.296 2.050 5 50 CEBA C[C@H]1CC(=O)NN=C1c1ccc(Cl)c([N+](=O)[O-])c1 445479 YJXLFWFRDVWRSY-LURJTMIESA-N 267.672 2.108 5 50 CEBA O=[N+]([O-])c1cccc([C@]2(O)COc3ccccc3O2)c1 1515351 QLENPVPCJPGPLZ-AWEZNQCLSA-N 273.244 2.211 5 50 CEBA CCOC(=O)[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 55543908 GPLDOLMDLMVMEW-ZDUSSCGKSA-N 292.335 2.370 5 50 CEBA COC1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1 408518391 FLYITENZNGBSJB-UHFFFAOYSA-N 271.704 2.258 5 50 CEBA Cc1cccc(NCC2(CO)CCOCC2)c1[N+](=O)[O-] 188387764 RTQSXOXOJLGCRD-UHFFFAOYSA-N 280.324 2.104 5 50 CEBA O=[N+]([O-])c1ccccc1OCCNCc1ccco1 2509641 YFFKHYNYEPTYJY-UHFFFAOYSA-N 262.265 2.356 5 50 CEBA CCOC(=O)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 55543688 NRGBVJPPBFDBRV-UHFFFAOYSA-N 292.335 2.370 5 50 CEBA Cc1ccc([C@@H]2CCCN2C(=O)[C@H]2C[C@@H]2[N+](=O)[O-])s1 170626986 HZBMORQXPWKPQK-DCAQKATOSA-N 280.349 2.385 5 50 CEBA CC[C@H]1CN(c2ncccc2[N+](=O)[O-])[C@@H](CC)CO1 585090432 MVDDTETXMGOLIJ-QWRGUYRKSA-N 265.313 2.384 5 50 CEBA O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCCC1 288656 OIGUEMSERRIJBO-UHFFFAOYSA-N 254.673 2.484 5 50 CEBA COc1ccc(C(=O)Nc2ccncc2)cc1[N+](=O)[O-] 440567 YYPZROTVEZQVQG-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA O=C(NC(=S)Nc1cccc([N+](=O)[O-])c1)C1CCC1 615448 AHRHWYZZRCECOK-UHFFFAOYSA-N 279.321 2.208 5 50 CEBA CCCCCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 1655552 HMKTZTGMSGRPHW-UHFFFAOYSA-N 286.353 2.453 5 50 CEBA O=[N+]([O-])c1n[nH]cc1-c1noc(-c2ccccc2)n1 4809700 GJAJNKNSUXTZFW-UHFFFAOYSA-N 257.209 2.035 5 50 CEBA C[C@@H](Nc1ccc([N+](=O)[O-])cn1)[C@@H](O)Cc1ccccc1 120645079 VSNNRMRJOHMCLC-RISCZKNCSA-N 287.319 2.394 5 50 CEBA C[C@@H](Nc1ccc([N+](=O)[O-])cn1)[C@H](O)Cc1ccccc1 120644760 VSNNRMRJOHMCLC-BXUZGUMPSA-N 287.319 2.394 5 50 CEBA C[C@@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 464461 XZAAEPTZJMPZTJ-ZOUVEMKTSA-N 290.319 2.244 5 50 CEBA CCOC(=O)NC/C=C/c1cccc([N+](=O)[O-])c1 3121840 KKFXAXGAVXDGKR-GQCTYLIASA-N 250.254 2.354 5 50 CEBA CN(C)c1cc(CNc2cc(N)ccc2[N+](=O)[O-])ccn1 192776259 IZISPKGFEZNROU-UHFFFAOYSA-N 287.323 2.250 5 50 CEBA Cc1ccc(C(=O)n2nnc3ccccc32)cc1[N+](=O)[O-] 102065 XWKFGJPXWSWHDR-UHFFFAOYSA-N 282.259 2.336 5 50 CEBA CC1=CC[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]2C1 440003 XSFLPRLCSDPYRO-OLZOCXBDSA-N 286.287 2.441 5 50 CEBA O=[N+]([O-])c1cc(Br)c2c(c1)OCCO2 4532176 RZBNPFYBXKERGL-UHFFFAOYSA-N 260.043 2.129 5 50 CEBA O=[N+]([O-])c1ccc(N2CCOC[C@H]2Cc2ccccc2)nc1 426879030 NWXHMLIYKSUCBI-OAHLLOKOSA-N 299.330 2.438 5 50 CEBA CCOCCC(=O)Nc1ccc([N+](=O)[O-])cc1C 4740554 WWRRSYNOZHCPPR-UHFFFAOYSA-N 252.270 2.268 5 50 CEBA COC(=O)c1ccc(Br)c([N+](=O)[O-])c1C 113537780 SFOUMZZLBCFDEN-UHFFFAOYSA-N 274.070 2.452 5 50 CEBA O=[N+]([O-])c1ccc(NCc2ccco2)c2nonc12 4362075 WJEGDQCORKFUSN-UHFFFAOYSA-N 260.209 2.336 5 50 CEBA Cc1ccc(NC(=O)Cn2c([N+](=O)[O-])cnc2C)cc1C 245602 QBLAIQRASBKQJH-UHFFFAOYSA-N 288.307 2.355 5 50 CEBA O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)c1 101479136 UXQHTIJOCUWHAR-OUJBWJOFSA-N 296.348 2.062 5 50 CEBA Cc1n[nH]c(Nc2cccc(C(=O)O)c2)c1[N+](=O)[O-] 3998418 ANJGXLMLBZPELZ-UHFFFAOYSA-N 262.225 2.068 5 50 CEBA O=C(c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])o1 4543052 BQGVDKDIPMSFRR-UHFFFAOYSA-N 262.177 2.327 5 50 CEBA CCC(=O)c1ccc(N2C[C@H](CN)[C@@H](C)C2)c([N+](=O)[O-])c1 864586802 XUIQKUJUKXWJKH-JQWIXIFHSA-N 291.351 2.219 5 50 CEBA Cc1nonc1O[C@@H](C)CNc1ccc([N+](=O)[O-])cc1 3877925 OQWWABIXMUFBIU-QMMMGPOBSA-N 278.268 2.166 5 50 CEBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)CCN1 3878505 CNROPYCGZCFWJI-QMMMGPOBSA-N 255.705 2.046 5 50 CEBA Cc1n[nH]c(C)c1CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 301128380 VWSNKUOGTLRAOE-UHFFFAOYSA-N 291.267 2.455 5 50 CEBA CC(C)(C)OC(=O)NCCOc1ccc([N+](=O)[O-])cc1 68940222 LDOYKECYRDLCDM-UHFFFAOYSA-N 282.296 2.498 5 50 CEBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1c1cccc(O)c1 227047 VARVCHCPSUXGSP-UHFFFAOYSA-N 284.227 2.101 5 50 CEBA Cc1cc(NC[C@H](C)O)c(Br)cc1[N+](=O)[O-] 225591405 COCYQXYAOSFGRK-ZETCQYMHSA-N 289.129 2.458 5 50 CEBA CN1CCC(N(C)Cc2cccc([N+](=O)[O-])c2)CC1 201850 VMOLHAFMZBMOMF-UHFFFAOYSA-N 263.341 2.121 5 50 CEBA O=[N+]([O-])c1cnn([C@H]2CCCCO2)c1Br 95704755 LGGFJFNRBLOXGF-SSDOTTSWSA-N 276.090 2.253 5 50 CEBA C[C@H]1CCCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] 5064096 RZIWJUFTWNMJSQ-VIFPVBQESA-N 263.297 2.073 5 50 CEBA C[S@@](=O)C1(CNc2ccc(F)cc2[N+](=O)[O-])CCC1 253432960 QEEJQYFBSQWYCH-LJQANCHMSA-N 286.328 2.447 5 50 CEBA O=C(COC(=O)c1ccco1)c1ccc([N+](=O)[O-])cc1 62301 ZJPHEYRDEFJNHS-UHFFFAOYSA-N 275.216 2.228 5 50 CEBA CN(C)C(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1 475019 VVOGOIJWTYKKRP-UHFFFAOYSA-N 297.361 2.385 5 50 CEBA Cc1c(OCC(N)=O)ccc2c1oc(=O)c1ccccc12 46590 ISMOEJIEGLZSKM-UHFFFAOYSA-N 283.283 2.119 5 50 CEBA O=[N+]([O-])c1ccc(NC(=S)NCc2cccnc2)cc1 5589206 AWLYIFHQUPAEEM-UHFFFAOYSA-N 288.332 2.476 5 50 CEBA CCOc1cccc(N2C[C@@H]3CC[C@H](C2)O3)c1[N+](=O)[O-] 364878927 QHHATXKDVRGICS-PHIMTYICSA-N 278.308 2.361 5 50 CEBA CCOCCCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1 2821290 ICASSOBVKOFPNY-BQYQJAHWSA-N 278.308 2.151 5 50 CEBA CCC[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517247 WSJNAXWRYWZIBW-VIFPVBQESA-N 283.240 2.168 5 50 CEBA Cc1c(NC(=O)NC[C@@H](C)CN(C)C)cccc1[N+](=O)[O-] 585086461 HUGAAMZQRQZELJ-SNVBAGLBSA-N 294.355 2.222 5 50 CEBA C[N+]1(C)CCC[C@H]1c1cc(Br)cnc1N 19760568 VRYZQXKLNLFTAI-JTQLQIEISA-N 271.182 2.338 5 50 CEBA biogenic,in-vitro Cc1ccnc(N2CC[C@@H](CCN(C)C)C2)c1[N+](=O)[O-] 904217386 CDXGBIAJUYCKHG-GFCCVEGCSA-N 278.356 2.076 5 50 CEBA Cc1ccc([N+](=O)[O-])c(OCCCN2CCOCC2)c1 20639723 PSTNIPOBLIYZFM-UHFFFAOYSA-N 280.324 2.004 5 50 CEBA CCc1ccccc1NC(=O)Cn1nc([N+](=O)[O-])cc1C 2883315 IWWCUHHUPKNJGQ-UHFFFAOYSA-N 288.307 2.301 5 50 CEBA C[C@@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1 4406361 XPYGLMJMRRVFAU-MRVPVSSYSA-N 289.257 2.412 5 50 CEBA O=C(O)c1cc([N+](=O)[O-])c2nc3ccccn3c2c1 20436657 CLYUFUBUXPAUOF-UHFFFAOYSA-N 257.205 2.094 5 50 CEBA Cc1ccc(CN[C@H](C)C[C@@H](C)O)cc1[N+](=O)[O-] 228068498 GCLFEVMDWZLKTQ-GHMZBOCLSA-N 252.314 2.152 5 50 CEBA C[C@H]1CN(c2cc([N+](=O)[O-])ccc2Cl)C[C@H](C)N1 258649 HZFONUHGJQMUKR-IUCAKERBSA-N 269.732 2.435 5 50 CEBA O=[N+]([O-])c1cc([N+](=O)[O-])c(N2CCCCC2)c([N+](=O)[O-])c1 100517036 PELVDFPFGQPDGS-UHFFFAOYSA-N 296.239 2.402 5 50 CEBA Cc1nc([C@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2)no1 225836843 WXVVMOVBJQTKSM-ZETCQYMHSA-N 291.267 2.169 5 50 CEBA Nc1cc2c(cc1[N+](=O)[O-])OC(F)(F)C(F)(F)O2 604221827 VVSOBOYDVQQMMC-UHFFFAOYSA-N 268.122 2.134 5 50 CEBA CC1=C(C)CN(c2c([N+](=O)[O-])c(C)nn2C)CC1 241124226 JGMVNVSYYUBZKV-UHFFFAOYSA-N 250.302 2.183 5 50 CEBA CC1(C)C[C@H]2C[C@@](C)(CN2c2ncnc(N)c2[N+](=O)[O-])C1 100815528 JSDMQIXCBKVNSW-LKFCYVNXSA-N 291.355 2.372 5 50 CEBA Cc1nn(CC(=O)Nc2ccc(F)cc2)c(C)c1[N+](=O)[O-] 1056744 FMVXGYXMMWRFAK-UHFFFAOYSA-N 292.270 2.186 5 50 CEBA CC(C)OC(=O)CSc1ccc([N+](=O)[O-])cn1 2860908 QTDWKIFAHHDJNK-UHFFFAOYSA-N 256.283 2.034 5 50 CEBA O=C1[C@H]2CC=CC[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 13475716 NTINCPQSZRXXQY-RYUDHWBXSA-N 272.260 2.050 5 50 CEBA Cc1ccc(NC(=O)CCCC(=O)O)cc1[N+](=O)[O-] 2156132 GDRGCHJYNCAHFV-UHFFFAOYSA-N 266.253 2.097 5 50 CEBA Cn1c(=O)c([N+](=O)[O-])c(N2CCCC2)c2ccccc21 4310031 RDCSGQHBMDVODV-UHFFFAOYSA-N 273.292 2.047 5 50 CEBA CCCn1cc(Nc2cnc([N+](=O)[O-])c(O)c2)cn1 1616037599 NARSSLBRSSLJHG-UHFFFAOYSA-N 263.257 2.046 5 50 CEBA CCN(CC)CCN(C)Cc1ccc([N+](=O)[O-])cc1 234506 KGUSEAVEYJEXDA-UHFFFAOYSA-N 265.357 2.368 5 50 CEBA Cc1cc(OCCN2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] 20167855 NHKYKIXKLYGSPU-STQMWFEESA-N 294.351 2.391 5 50 CEBA Cc1nc(N(C)C2CCC(O)CC2)ccc1[N+](=O)[O-] 170086568 WOFLNDPMWGVASR-UHFFFAOYSA-N 265.313 2.038 5 50 CEBA CN(CC1CCCCC1)c1ncc([N+](=O)[O-])cc1C(N)=O 192902935 LONCUBCQKNUYKA-UHFFFAOYSA-N 292.339 2.105 5 50 CEBA O=C(c1ccccc1[N+](=O)[O-])n1nnc2ccccc21 255427 QPSDPYKDZGDKDS-UHFFFAOYSA-N 268.232 2.028 5 50 CEBA O=C1[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 239038650 DPOMYZXSOZARSI-RBJBARPLSA-N 286.287 2.130 5 50 CEBA Cc1nn(CCCC(=O)N2CCCCC2)c(C)c1[N+](=O)[O-] 1432085 AZEDXUWOLNKOBN-UHFFFAOYSA-N 294.355 2.201 5 50 CEBA Cc1cc(-c2nc(-c3ccc([N+](=O)[O-])o3)no2)no1 121972 ONSGVSDDBSVJFS-UHFFFAOYSA-N 262.181 2.201 5 50 CEBA COc1ccc([C@H](NC(=O)[C@H]2C[C@H]2[N+](=O)[O-])C(C)C)cc1 248263500 WZZCIDDVFWYTFY-BFHYXJOUSA-N 292.335 2.174 5 50 CEBA O=[N+]([O-])c1ccc2[nH]nc(I)c2c1 14983540 UCTRCMYXPOXOSN-UHFFFAOYSA-N 289.032 2.076 5 50 CEBA in-vitro CC1(C)CC(=O)C(C(=O)c2ccc([N+](=O)[O-])cc2)C(=O)C1 100319427 KESBOEBJMZKRMH-UHFFFAOYSA-N 289.287 2.352 5 50 CEBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(F)c2)n1 1432483 QLQOCYYEUUYXCL-UHFFFAOYSA-N 278.243 2.203 5 50 CEBA CC[C@@H](C(=O)O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 90414066 HCGPXJPXFRMKMP-SSDOTTSWSA-N 254.198 2.081 5 50 CEBA in-vitro O=[N+]([O-])c1cnc(Nc2ccc(O)cc2)c([N+](=O)[O-])c1 3880509 NPUBTAPNNPACRY-UHFFFAOYSA-N 276.208 2.347 5 50 CEBA CCN(CC)CCN(C)Cc1cccc([N+](=O)[O-])c1 4989515 MLMKITLWPXYRCO-UHFFFAOYSA-N 265.357 2.368 5 50 CEBA Nc1ncnc(Nc2ccccc2Cl)c1[N+](=O)[O-] 3912549 WJAGWCTUOUUFCL-UHFFFAOYSA-N 265.660 2.364 5 50 CEBA Cc1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)n1 35161 BEFGZIVUXVZKMN-UHFFFAOYSA-N 287.275 2.316 5 50 CEBA O=C(N=c1[nH]c2ccccc2[nH]1)c1ccc([N+](=O)[O-])cc1 2740281 ATJLQYUJQCDLFC-UHFFFAOYSA-N 282.259 2.145 5 50 CEBA COc1ccc(CC(=O)Nc2ncc([N+](=O)[O-])s2)cc1 4832126 SWGGAULQCPETHL-UHFFFAOYSA-N 293.304 2.241 5 50 CEBA O=[N+]([O-])c1cnc(NC[C@@H]2CCCNC2)c(Cl)c1 236051732 RJELRIXSSNSRFR-MRVPVSSYSA-N 270.720 2.055 5 50 CEBA Cc1ncc([N+](=O)[O-])n1Cc1ccc(Cl)nc1 128087168 TUVOOQXVSWVFJH-UHFFFAOYSA-N 252.661 2.196 5 50 CEBA CC1=C[C@H]2C[C@H]1[C@@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12 239038463 DGHBLVQCGKCDAG-VKKKGTNTSA-N 298.298 2.296 5 50 CEBA COc1ccc(C(=O)n2nnc3ccccc32)cc1[N+](=O)[O-] 265852 WCQXFSFPDKBEIH-UHFFFAOYSA-N 298.258 2.037 5 50 CEBA O=[N+]([O-])c1c(F)cc(F)cc1I 1596422 ZSKLGMYXOHTYOW-UHFFFAOYSA-N 284.987 2.478 5 50 CEBA Cc1nn([C@@H](C)C(=O)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] 2776909 SSSYHYXDYDYNKC-ONGXEEELSA-N 280.328 2.062 5 50 CEBA Cc1c(CSc2cnn[nH]2)cccc1[N+](=O)[O-] 177375630 YMHDZPVKIRZOGN-UHFFFAOYSA-N 250.283 2.314 5 50 CEBA O=C1CC[C@@H](Nc2ccc(Cl)cc2[N+](=O)[O-])CCN1 396712802 PKNJWDXKAHCKAO-SECBINFHSA-N 283.715 2.329 5 50 CEBA CC(C)[C@H](Nc1sc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 5230953 LMBQXNOXQFXFJT-ZETCQYMHSA-N 289.269 2.086 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccccc2O)cc1 3156637 HIOPSLVWFVXQBR-UHFFFAOYSA-N 294.288 2.101 5 50 CEBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(F)c(Cl)c1 1067537 JVYIJMLWKVAAIW-UHFFFAOYSA-N 298.661 2.223 5 50 CEBA CN1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 3998638 TYTJRQMHDOGOIP-UHFFFAOYSA-N 289.257 2.365 5 50 CEBA CC1=C[C@H]2C[C@H]1[C@H]1C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]21 239254664 YPYRWGPJAJGEOF-GSVCSZOMSA-N 298.298 2.296 5 50 CEBA CCOC(=O)[C@@H](CC)Oc1ccccc1[N+](=O)[O-] 70242785 URCHNMFROJPJJA-SNVBAGLBSA-N 253.254 2.315 5 50 CEBA NS(=O)(=O)c1ccc2oc3cc([N+](=O)[O-])ccc3c2c1 2879414 LNNUKLINSHPHPX-UHFFFAOYSA-N 292.272 2.142 5 50 CEBA O=Cc1c(N2CCC(F)(F)C2)cccc1[N+](=O)[O-] 169725220 BQDVETZYLIIQKZ-UHFFFAOYSA-N 256.208 2.253 5 50 CEBA COc1ccc(CSc2nc(C)n[nH]2)cc1[N+](=O)[O-] 1296499 MQXOMGMYFIGJAP-UHFFFAOYSA-N 280.309 2.322 5 50 CEBA C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 4010545 AYPUWLHKVAJKHN-QWRGUYRKSA-N 298.364 2.261 5 50 CEBA C[C@@]1(NC(=O)c2cc(F)ccc2[N+](=O)[O-])CCCOC1 221706057 NEBRZGDWPJYFQL-CYBMUJFWSA-N 282.271 2.033 5 50 CEBA Cc1nc(NCc2cnn3c2CCCC3)ccc1[N+](=O)[O-] 952993724 PUDOCQYRYXWZRJ-UHFFFAOYSA-N 287.323 2.443 5 50 CEBA O=C(NCCc1ccccc1)c1ccc([N+](=O)[O-])o1 38973 SJKVNWXSVBJHHH-UHFFFAOYSA-N 260.249 2.160 5 50 CEBA CC(C)[C@H]1N(c2c([N+](=O)[O-])ncn2C)CC1(C)C 292879305 YSFWAGHDWXGPDQ-SECBINFHSA-N 252.318 2.199 5 50 CEBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC(F)(F)C1 334337555 WDGXSFQLDHIUPP-UHFFFAOYSA-N 270.235 2.005 5 50 CEBA O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC(F)(F)C1 313419420 BPWLSEWLRVPQJQ-UHFFFAOYSA-N 274.198 2.215 5 50 CEBA C[C@@H]1Cn2c(nnc2-c2cccc([N+](=O)[O-])c2)S1 1059892 OLKUVDRWIDXPKM-SSDOTTSWSA-N 262.294 2.348 5 50 CEBA CN(c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 1856206 HMMKUMATMNDVHN-UHFFFAOYSA-N 292.316 2.420 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N2C[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)c1 367166668 VGDFXRQXKNLHTQ-FIRSBJHFSA-N 259.309 2.412 5 50 CEBA Cc1nn([C@H](C)C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] 295432377 UYSUQXCRDRUTHS-CKYFFXLPSA-N 294.355 2.165 5 50 CEBA C[C@@H](C(=O)Nc1ccc(F)c(F)c1)n1cc([N+](=O)[O-])cn1 1423778 FELBFAJQHMQABZ-ZETCQYMHSA-N 296.233 2.269 5 50 CEBA O=C(O)c1cc([N+](=O)[O-])ccc1NCc1cccnc1 4183294 UNRHHSLXQOXJTL-UHFFFAOYSA-N 273.248 2.300 5 50 CEBA Cc1cc([N+](=O)[O-])cnc1N1CCC(C)(N(C)C)CC1 585132799 WOABKDMUKOUJLH-UHFFFAOYSA-N 278.356 2.219 5 50 CEBA NC(=O)c1ccc(N2CCCCCC2)c([N+](=O)[O-])c1 4755416 JSIMBHAVKWNJLK-UHFFFAOYSA-N 263.297 2.074 5 50 CEBA CCO[C@@H](C)n1cc([N+](=O)[O-])c(Br)n1 616567829 DIGNCMYDOXOTGL-YFKPBYRVSA-N 264.079 2.109 5 50 CEBA O=C(O)c1c2ccccc2nc2cc(O)cc(O)c12 100124717 JYTNCILGSJWIDM-UHFFFAOYSA-N 255.229 2.497 5 50 CEBA Cc1cc([N+](=O)[O-])nn1C(=O)c1c(F)cccc1F 484261 VAXAEQPZNYBMRU-UHFFFAOYSA-N 267.191 2.066 5 50 CEBA C[C@@H]1CC[C@@H](C)N1C[C@@H](O)COc1ccccc1[N+](=O)[O-] 221793044 MSMJYDCOQBSJLG-JHJVBQTASA-N 294.351 2.207 5 50 CEBA CC[C@H]1COC(C)(C)CN1c1ncccc1[N+](=O)[O-] 585090356 COLPCTRIMIKYBC-JTQLQIEISA-N 265.313 2.384 5 50 CEBA O=C1[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)N1c1cccc([N+](=O)[O-])c1 239287398 CRWINWFOCXTDSK-RBJBARPLSA-N 286.287 2.130 5 50 CEBA O=[N+]([O-])c1ccc(CN2CCN(CCCF)CC2)cc1 585123551 WHZABNCAACMWJT-UHFFFAOYSA-N 281.331 2.072 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N2CCO[C@@H](c3ccco3)C2)c1 193472635 PBNKSVLMYBSNGR-CQSZACIVSA-N 289.291 2.348 5 50 CEBA CC1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 4854682 ZUDCDAJKCMJVDN-UHFFFAOYSA-N 277.324 2.265 5 50 CEBA Cc1cccc(OCC(=O)Nc2cc([N+](=O)[O-])ccn2)c1 881409 WSGMUDMIWNRZLG-UHFFFAOYSA-N 287.275 2.316 5 50 CEBA CCc1cnc(CNc2cc(C)c([N+](=O)[O-])cn2)[nH]1 719150001 TVUSMWZNRPDTCK-UHFFFAOYSA-N 261.285 2.196 5 50 CEBA Cc1nn2c(c1[N+](=O)[O-])NCC[C@@H]2C(F)(F)F 1857783070 MXSHMNCOYOWICR-RXMQYKEDSA-N 250.180 2.019 5 50 CEBA CCOc1cccc(N2CC[C@H](C)[C@@H](O)C2)c1[N+](=O)[O-] 221832567 HWPBIUFPDPSRRD-JQWIXIFHSA-N 280.324 2.201 5 50 CEBA N=c1c2c(=O)oc3ccccc3c2ccn1C[C@H]1CCCO1 1848442785 JIWIOYIYCZHTAJ-LLVKDONJSA-N 296.326 2.406 5 50 CEBA O=[N+]([O-])c1cc2cc(Br)ccc2[n+]([O-])c1 113656938 WEYVRXWYEJTSFH-UHFFFAOYSA-N 269.054 2.144 5 50 CEBA CCC(=O)NC(=S)Nc1ccc(Cl)c([N+](=O)[O-])c1 455722 NRFRIGODZTYAGY-UHFFFAOYSA-N 287.728 2.471 5 50 CEBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@@H]2OCCC[C@@H]21 192621591 AZIFUXWYXGWMCM-WZRBSPASSA-N 290.319 2.201 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N[C@@H]2c3ccccc3C[C@H]2O)c1 193386032 LMNHQNQJPZWYFW-HUUCEWRRSA-N 285.303 2.247 5 50 CEBA C[C@@H]1Cc2ccccc2N1c1ncnc(N)c1[N+](=O)[O-] 4059601 IQECUWFFIFFPBO-MRVPVSSYSA-N 271.280 2.050 5 50 CEBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@H]1C(F)F 864091478 XFMQCZRYOZMNKG-KCJUWKMLSA-N 299.277 2.261 5 50 CEBA C[C@]12C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]1[C@H]1C=C[C@H]2C1 239175757 QPHSVVNVYBKYKQ-CGEOFPBHSA-N 298.298 2.296 5 50 CEBA O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1[N+](=O)[O-])[C@H]1C=C[C@H]2CC1 100171575 JHIYHOXVZRXRNS-NUZBWSBOSA-N 298.298 2.296 5 50 CEBA COC(=O)c1sc2cc([N+](=O)[O-])ccc2c1N 32573 AVWYTSRBVOQDRA-UHFFFAOYSA-N 252.251 2.178 5 50 CEBA NC(=O)c1cc(Br)c(Cl)cc1[N+](=O)[O-] 216699327 GXFMZQMWFNVVFU-UHFFFAOYSA-N 279.477 2.110 5 50 CEBA O=[N+]([O-])c1ccc(-c2nnn(CNc3ccccc3)n2)cc1 93395 ZVANVUNZWIJPAH-UHFFFAOYSA-N 296.290 2.318 5 50 CEBA Cc1c([N+](=O)[O-])ncn1CC(=O)C1CCC(F)(F)CC1 1775999109 PWLYRMMILJGQLQ-UHFFFAOYSA-N 287.266 2.494 5 50 CEBA CCn1ncc(CNC(=O)c2ccc([N+](=O)[O-])cc2)c1C 2767879 WFSRJPKVDKFSCM-UHFFFAOYSA-N 288.307 2.050 5 50 CEBA O=C(NC1CCCC1)c1ccc([N+](=O)[O-])cc1F 54126893 WKSQMOLVQNWPAD-UHFFFAOYSA-N 252.245 2.406 5 50 CEBA CC1=C[C@H]2C[C@H]1[C@H]1C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]21 100716301 YPYRWGPJAJGEOF-KQURDKLPSA-N 298.298 2.296 5 50 CEBA Cc1cccc(C(=O)N2C[C@H](C)O[C@H](C)C2)c1[N+](=O)[O-] 17836934 JQQHBAMVTIZNBY-PHIMTYICSA-N 278.308 2.153 5 50 CEBA COC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 14909865 NKUYYWCQLGHYLF-UHFFFAOYSA-N 274.070 2.452 5 50 CEBA CC(C)c1cccc2c1CC[N+]1(CCS(=O)(=O)CC1)C2 1775988786 IODYWWVRTKPRBW-UHFFFAOYSA-N 294.440 2.111 5 50 CEBA O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cnns1 170603837 GEJUDHANDBNVQP-UHFFFAOYSA-N 296.333 2.177 5 50 CEBA CC(=O)OC(OC(C)=O)c1ccc(Cl)cc1[N+](=O)[O-] 3132357 JFZSKYRYLDKGRC-UHFFFAOYSA-N 287.655 2.373 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCCC[C@H]1CO 6667544 RJVZKZOXOOVCRK-DYLGSBMWSA-N 276.336 2.455 5 50 CEBA Cc1cc(OCCCN2CCOCC2)ccc1[N+](=O)[O-] 20118076 YPNFEMBSRIUPTQ-UHFFFAOYSA-N 280.324 2.004 5 50 CEBA CS[C@H](CO)[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(C)=O)c1 239653794 BLKDTGSSUPXNDP-AMIZOPFISA-N 298.364 2.322 5 50 CEBA O=[N+]([O-])c1ccc(NCCCO)c(C(F)(F)F)c1 4819116 KLTFJGOLYNHARU-UHFFFAOYSA-N 264.203 2.408 5 50 CEBA in-vitro COc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)c(OC)c1 183126 RDXPSPVPWLUMAT-UHFFFAOYSA-N 292.247 2.457 5 50 CEBA O=C(c1cccc([N+](=O)[O-])c1)c1cn2ccccc2n1 34328664 ZUQMHJUHWNTNAK-UHFFFAOYSA-N 267.244 2.474 5 50 CEBA Cc1ccnc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 449523 UIIYCNPVNBXZPX-UHFFFAOYSA-N 283.243 2.099 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H](O)C1 4988825 ZPHKJRKWWFKLKH-YIALFULDSA-N 262.309 2.065 5 50 CEBA CC[C@@H](Nc1nccc(CO)n1)c1cccc([N+](=O)[O-])c1 341606183 HZOFEVDIXZMMEA-CYBMUJFWSA-N 288.307 2.440 5 50 CEBA CC(=O)C(Sc1ccccc1[N+](=O)[O-])C(C)=O 101403245 PEOWJYFDVGGZAJ-UHFFFAOYSA-N 253.279 2.234 5 50 CEBA COC(=O)c1c(Br)cccc1[N+](=O)[O-] 71605813 CBQNPPDKHCOWGD-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA in-vitro Cc1ccc2c(c1)[n+]([O-])c1cc(Cl)ccc1[n+]2[O-] 4285542 AGTCFLWOSGBOAU-UHFFFAOYSA-N 260.680 2.222 5 50 CEBA Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCOC1 314002311 JXWTYDIWMWWPKP-JTQLQIEISA-N 296.298 2.199 5 50 CEBA O=C(O)Cc1c(F)cc(C(F)(F)F)cc1[N+](=O)[O-] 1772572545 LPTQAJOBUFWJLA-UHFFFAOYSA-N 267.134 2.380 5 50 CEBA COC(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 473278 RAPHVMRKTITFGV-UHFFFAOYSA-N 253.239 2.383 5 50 CEBA CC(=O)Cc1c(C=O)c2cc([N+](=O)[O-])ccc2n1C 22779502 QNJFCYSYAUZXSC-UHFFFAOYSA-N 260.249 2.031 5 50 CEBA CS[C@H](CO)[C@H](C)Nc1ccc([N+](=O)[O-])c(C(C)=O)c1 239653796 BLKDTGSSUPXNDP-ISVAXAHUSA-N 298.364 2.322 5 50 CEBA Cc1cccc(NC(=O)Cn2c([N+](=O)[O-])cnc2C)c1C 350594 LHOONNZYINPBLX-UHFFFAOYSA-N 288.307 2.355 5 50 CEBA O=[N+]([O-])c1cnc(Nc2cccc(O)c2)c([N+](=O)[O-])c1 3880508 SCVFUGNWYODCLM-UHFFFAOYSA-N 276.208 2.347 5 50 CEBA Cn1nc(Br)c2ccc([N+](=O)[O-])cc21 28540315 ZXRDKEHXTGDEHC-UHFFFAOYSA-N 256.059 2.244 5 50 CEBA CC(C)c1scnc1NC(=O)Cn1cc([N+](=O)[O-])cn1 288883758 OWOISPVUPOGCIN-UHFFFAOYSA-N 295.324 2.010 5 50 CEBA CN(C)[C@]1(C)CCN(c2sccc2[N+](=O)[O-])C1 1875275245 JJSYRPQIEHNGAM-LLVKDONJSA-N 255.343 2.187 5 50 CEBA COc1ccc(C(=O)Nc2ccccn2)cc1[N+](=O)[O-] 117082 XVYPXEIMWPYYRZ-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA Cc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 1231015 CHXKZLJHFUMIHC-UHFFFAOYSA-N 269.200 2.197 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N2C[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]32)c1 367166659 VGDFXRQXKNLHTQ-CITXGKJTSA-N 259.309 2.412 5 50 CEBA Cn1nc([N+](=O)[O-])nc1Oc1cccc2cccnc12 201638 BBKACMQEKPZARV-UHFFFAOYSA-N 271.236 2.064 5 50 CEBA CC(=O)Nc1ccc(OC(F)(F)F)cc1[N+](=O)[O-] 4289473 UCLBQTSVYJDQRU-UHFFFAOYSA-N 264.159 2.452 5 50 CEBA O=C(Cc1ccccc1)Nc1cc([N+](=O)[O-])ccc1O 35832776 OMESAAINUZGONG-UHFFFAOYSA-N 272.260 2.482 5 50 CEBA O=[N+]([O-])c1cccnc1OCC(F)(F)C(F)F 258840012 YTMXEIVDBOHIOP-UHFFFAOYSA-N 254.139 2.269 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2C[C@H]3CC[C@H]2C3)cc1 101597397 YUFKLKBIXHGELG-KWBADKCTSA-N 296.348 2.062 5 50 CEBA O=C(O)c1cccc(Cn2cc(Cl)c([N+](=O)[O-])n2)c1 368964 WRLCQPPOOLUGKO-UHFFFAOYSA-N 281.655 2.191 5 50 CEBA CC1(C)OCc2c1[nH]c(-c1ccc([N+](=O)[O-])cc1)nc2=O 1776004858 ZWFAKUCJFBRMQT-UHFFFAOYSA-N 287.275 2.110 5 50 CEBA Cc1cc(C(=O)N2CCC[C@H]([C@H](C)N)C2)cc([N+](=O)[O-])c1 135237294 SXHCEVOZEOEIIK-RYUDHWBXSA-N 291.351 2.103 5 50 CEBA O=[N+]([O-])c1ccc(N2CC[C@H](O)[C@@H]3CCCC[C@H]32)nc1 601252601 NWDPTNKAISWRJG-UPJWGTAASA-N 277.324 2.120 5 50 CEBA Cc1ccccc1[C@@H](O)Cn1nc([N+](=O)[O-])cc1C 170078239 WKOHGVDQNKYAAF-LBPRGKRZSA-N 261.281 2.142 5 50 CEBA O=[N+]([O-])c1ccc(OCCN2CCCCC2)cc1 4989706 HLQQRQNEDYOBHS-UHFFFAOYSA-N 250.298 2.460 5 50 CEBA O=[N+]([O-])c1ccccc1CN1CCCC[C@@H]1CCO 16513799 DNQFUKZVUDSZMN-CYBMUJFWSA-N 264.325 2.332 5 50 CEBA CC[C@@H](CO)NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C 191375771 ADFJZOZEPAKPAV-JTQLQIEISA-N 281.312 2.104 5 50 CEBA Cc1cc(C)nc(NNc2ccc([N+](=O)[O-])cc2)n1 4476897 LZDOVFZLVULRGK-UHFFFAOYSA-N 259.269 2.441 5 50 CEBA CCn1c2cc(=NCCO)ccc-2nc2ccccc21 334156953 RDLNSUAPPVNBCO-UHFFFAOYSA-N 267.332 2.054 5 50 CEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccncc1 616005 UQFWWVPLAJRPRI-UHFFFAOYSA-N 273.248 2.007 5 50 CEBA Cc1ccc(C)c(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 1070293 HVLAFYNKJARMFG-UHFFFAOYSA-N 274.280 2.047 5 50 CEBA COc1cc(CN2CCCCC2)cc([N+](=O)[O-])c1O 4989056 GJHOYSJKMZUICX-UHFFFAOYSA-N 266.297 2.295 5 50 CEBA Cc1cc(F)ccc1[C@@H](O)Cn1nc([N+](=O)[O-])cc1C 170078245 RQYCYWIFZBWICJ-LBPRGKRZSA-N 279.271 2.281 5 50 CEBA O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H]1C=C[C@H](CO)C1)CCC2 192966980 FULATJZLRXIPDV-GHJWDPDVSA-N 288.347 2.499 5 50 CEBA NC(=O)c1ccc(NCCc2ccccc2)c([N+](=O)[O-])c1 5064472 FFEPHEJMIVWUQF-UHFFFAOYSA-N 285.303 2.348 5 50 CEBA O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@@](F)(CO)C1 253392799 GIZAGSSBJCTMEU-NSHDSACASA-N 274.679 2.159 5 50 CEBA CC(C)[C@H](Nc1ncccc1[N+](=O)[O-])C(=O)N1CCCC1 301540135 BWXYLJAOHQTYAS-LBPRGKRZSA-N 292.339 2.049 5 50 CEBA COCCCNC(=S)Nc1ccc(C)cc1[N+](=O)[O-] 13519774 NFIIGTCZCFTKLB-UHFFFAOYSA-N 283.353 2.226 5 50 CEBA C[C@@H]1CCCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] 5064095 RZIWJUFTWNMJSQ-SECBINFHSA-N 263.297 2.073 5 50 CEBA CN(CCc1ccccn1)Cc1ccc([N+](=O)[O-])o1 13234179 HPVRUAPKLKLYLB-UHFFFAOYSA-N 261.281 2.257 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCOCC1 4244903 UNDXPKDBFOOQFC-UHFFFAOYSA-N 276.214 2.450 5 50 CEBA CCC[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C1CCC1 413448210 JEPYSHSRJCBAOB-LLVKDONJSA-N 292.339 2.469 5 50 CEBA COc1cccc(NCCc2cnccn2)c1[N+](=O)[O-] 346043379 GYRAAQATZMWZJM-UHFFFAOYSA-N 274.280 2.048 5 50 CEBA Cn1nnc2cc(C(=O)Nc3cccc([N+](=O)[O-])c3)ccc21 619733 CICSWPHIPFNSSS-UHFFFAOYSA-N 297.274 2.129 5 50 CEBA O=C(NCc1cccnc1)Nc1cc([N+](=O)[O-])ccc1F 2173636 AAUIELHBGUYMFN-UHFFFAOYSA-N 290.254 2.451 5 50 CEBA C[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)C[C@@H](C2CC2)O1 408521038 GBFFIWCBVMDXBT-UFBFGSQYSA-N 281.287 2.133 5 50 CEBA CO[C@@H]1[C@H]2C[C@@H]3CN(c4ncc(C)cc4[N+](=O)[O-])[C@@H]1[C@H]3C2 286501621 YHUAYXJMPJFGEY-FUVSOYRFSA-N 289.335 2.158 5 50 CEBA CNC(=O)C(C)(C)CN[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 170594420 MOWATVHCFBNPCE-NSHDSACASA-N 293.367 2.326 5 50 CEBA O=c1c([N+](=O)[O-])cc(Br)cn1C1CCC1 1616024632 UCRMADDTLYUQCF-UHFFFAOYSA-N 273.086 2.244 5 50 CEBA CC(=O)c1c(C)nn(C(=O)c2cccc([N+](=O)[O-])c2)c1C 105672 JXEAOQUXGBYQFT-UHFFFAOYSA-N 287.275 2.299 5 50 CEBA CC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 49987 NJZWHPATRMRQTH-UHFFFAOYSA-N 289.247 2.399 5 50 CEBA C[C@H](NC[C@@H](C)[S@](C)=O)c1ccc([N+](=O)[O-])cc1 211268856 LXUBMYSFGRTNKQ-JJQCHNSYSA-N 270.354 2.012 5 50 CEBA COc1ccc(C(=O)NC(C)(C)C)cc1[N+](=O)[O-] 284743 GZEZLVYZNDEEGX-UHFFFAOYSA-N 252.270 2.132 5 50 CEBA CC(=O)Nc1cc(N2CCOCC2)c(Cl)cc1[N+](=O)[O-] 12364323 VSUNKOYEDWXAQB-UHFFFAOYSA-N 299.714 2.043 5 50 CEBA CCC[C@@H](C)NC(=O)Cc1ccccc1[N+](=O)[O-] 442468 OJHACMXUDLSPDQ-SNVBAGLBSA-N 250.298 2.442 5 50 CEBA CNc1c([N+](=O)[O-])cnn1-c1ccc(Cl)cc1 4073199 GFKGLEINTDIAFX-UHFFFAOYSA-N 252.661 2.476 5 50 CEBA Cn1ccnc1[C@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1 253394892 HCTXQBVKDRVJMW-VIFPVBQESA-N 293.352 2.169 5 50 CEBA COC(=O)CSc1nc2ccccc2cc1[N+](=O)[O-] 352361155 PZDMYPXIGQAQIJ-UHFFFAOYSA-N 278.289 2.408 5 50 CEBA Cc1cc(=O)[nH]c(SCc2ccc([N+](=O)[O-])cc2)n1 18094241 DZLSHRVBNSDZBD-UHFFFAOYSA-N 277.305 2.279 5 50 CEBA Nc1c([N+](=O)[O-])cnc2cc(Br)ccc12 231447303 RCSVAMYXGYIYHC-UHFFFAOYSA-N 268.070 2.488 5 50 CEBA COc1c(Br)cc([N+](=O)[O-])cc1[N+](=O)[O-] 1776111131 WMRVRFDTNCYXOY-UHFFFAOYSA-N 277.030 2.274 5 50 CEBA Cn1cc(CNc2ccccc2F)c([N+](=O)[O-])n1 1875358343 SAQLNUJRAPZCIC-UHFFFAOYSA-N 250.233 2.080 5 50 CEBA CCC[C@H](C)NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 449772 MORNFVRCBGZSAH-VIFPVBQESA-N 294.307 2.300 5 50 CEBA Cc1cc(N[C@H](CCC(C)(C)C)C(N)=O)ncc1[N+](=O)[O-] 225605059 NTNDTLRYLQWNEZ-SNVBAGLBSA-N 294.355 2.390 5 50 CEBA O=[N+]([O-])/C=C/Nc1cc([N+](=O)[O-])cc(Cl)c1O 2895262 SLVPPKVOLHSCCK-OWOJBTEDSA-N 259.605 2.114 5 50 CEBA CNc1cccc2c1c(=O)c1ccccc1c(=O)n2C 398960 OMCXSEVEQSFTFG-UHFFFAOYSA-N 266.300 2.094 5 50 CEBA O=c1c([N+](=O)[O-])c[nH]c2ccc(Br)cc12 16697272 AMKJVYOALDEARM-UHFFFAOYSA-N 269.054 2.199 5 50 CEBA in-vitro Cc1ccc([N+](=O)[O-])c(OCCCCn2cncn2)c1 2845128 UILCKCXTNCWNMP-UHFFFAOYSA-N 276.296 2.354 5 50 CEBA NC(=O)c1ccc(Oc2cccc([N+](=O)[O-])c2)cc1 255190175 VLEXVLSYRLPZMN-UHFFFAOYSA-N 258.233 2.486 5 50 CEBA O=[N+]([O-])c1c[nH]ccc1=NC[C@@H]1COCc2ccccc21 1875299805 WQQBUSDMXKELQG-GFCCVEGCSA-N 285.303 2.138 5 50 CEBA COC(=O)c1cc(C(=O)NCCC(C)C)cc([N+](=O)[O-])c1 442375 HHIGOCXMKUNLQG-UHFFFAOYSA-N 294.307 2.157 5 50 CEBA C[N+](C)=c1ccc2nc3ccc(N)cc3sc-2c1 100042483 HMYISFASHDWPMO-UHFFFAOYSA-O 256.354 2.015 5 50 CEBA CC(=O)c1cc([N+](=O)[O-])ccc1NCCC(=O)NC(C)C 242389223 ZVHWVXNTYYHULT-UHFFFAOYSA-N 293.323 2.124 5 50 CEBA O=[N+]([O-])c1ccc(NC[C@H]2CN3CCC2CC3)c(F)c1 1616036198 PKBWFEIISLYFGK-NSHDSACASA-N 279.315 2.488 5 50 CEBA O=[N+]([O-])c1ccc([S@@](=O)Nc2ccc(O)cc2)cc1 5731137 BROPCYYYAITPIA-IBGZPJMESA-N 278.289 2.435 5 50 CEBA CCOC(=O)COc1cc(C)c(Cl)cc1[N+](=O)[O-] 282338 LUHQDNQHZYZZHK-UHFFFAOYSA-N 273.672 2.499 5 50 CEBA Cc1cc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc(O)n1 121542545 OMOZVAKZZCUVBF-UHFFFAOYSA-N 287.275 2.280 5 50 CEBA Cc1ccc(Cl)cc1NC(=O)Cn1ccc([N+](=O)[O-])n1 1428147 SRSWLAMGNDDFSM-UHFFFAOYSA-N 294.698 2.392 5 50 CEBA CCCCN(CC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 2989201 UPHAUBATRGLLKC-UHFFFAOYSA-N 286.353 2.406 5 50 CEBA CC(=O)COc1ccc(Br)cc1[N+](=O)[O-] 83827059 GJIXLAQGZGIHTN-UHFFFAOYSA-N 274.070 2.325 5 50 CEBA CCC[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 442492 NCEYXYKIBWQTAY-SECBINFHSA-N 272.326 2.062 5 50 CEBA O=C(O)c1cc2c3ccccc3ccc2n2nnnc12 390834970 YCGGQOCHZGHJBG-UHFFFAOYSA-N 264.244 2.129 5 50 CEBA O=C(O)COc1ccc2c(c1)oc(=O)c1ccccc12 47689 ZLWOHWRZIZVLTP-UHFFFAOYSA-N 270.240 2.410 5 50 CEBA O=[N+]([O-])c1ccc(Cn2nnc3ccccc32)cc1 5520895 ZVDRIJWDOUDSQX-UHFFFAOYSA-N 254.249 2.388 5 50 CEBA Cc1cc(C)c([N+](=O)[O-])c(N2CCOC[C@H]2C2CC2)n1 408216698 VZMYXBCPCMYGAC-LBPRGKRZSA-N 277.324 2.222 5 50 CEBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H]1C(F)F 864091476 XFMQCZRYOZMNKG-GZMMTYOYSA-N 299.277 2.261 5 50 CEBA CCC[C@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 449777 MEPMUNSRBSAFTI-JTQLQIEISA-N 250.298 2.442 5 50 CEBA COc1cc(C(=O)NCCC(C)C)c([N+](=O)[O-])cc1OC 449840 JCYSXGLJLDCUQC-UHFFFAOYSA-N 296.323 2.388 5 50 CEBA Cc1cc(O)cc2oc(=O)c3c(O)cc(O)cc3c12 402623 CEBXXEKPIIDJHL-UHFFFAOYSA-N 258.229 2.371 5 50 CEBA endogenous,in-man Cc1cc(NCCNC(=O)NC(C)C)ccc1[N+](=O)[O-] 1615592683 ZAQNAYDDCZNSJZ-UHFFFAOYSA-N 280.328 2.023 5 50 CEBA COC(=O)CSc1[nH]c2ccccc2c1[N+](=O)[O-] 617099 SUGMGCIGXXXIMD-UHFFFAOYSA-N 266.278 2.341 5 50 CEBA CC1(C)C[N+]2(CCS(=O)(=O)CC2)C[C@H]1c1ccccc1 1615056191 HZLWZYBYIJGRKQ-HNNXBMFYSA-N 294.440 2.055 5 50 CEBA O=[N+]([O-])c1ccc(N2CCC[C@H](O)C2)c2ncccc12 4132256 JGUALWJFKXHCJW-JTQLQIEISA-N 273.292 2.104 5 50 CEBA COC(=O)c1ccc([N+](=O)[O-])c(Br)c1 47202241 JZNGTPNMJBXBIJ-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA in-vitro COc1ccc(N2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])c1 4011829 DSXDOHMNRWKJAA-UHFFFAOYSA-N 298.254 2.404 5 50 CEBA C[C@@H]1CN(CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 20167782 FCYJLRKXYVYLEN-VXGBXAGGSA-N 280.324 2.083 5 50 CEBA CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 4687557 QDAXFAWUFNGLJB-UHFFFAOYSA-N 297.742 2.307 5 50 CEBA COc1cc([N+](=O)[O-])cc(Br)c1C(=O)O 1536221433 HMXNSZRONDOFRZ-UHFFFAOYSA-N 276.042 2.064 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccccc1 67942 MLPVALKIJBKOGG-UHFFFAOYSA-N 278.289 2.396 5 50 CEBA Cn1c(CNc2ccc([N+](=O)[O-])cc2)nc2cccnc21 170595679 VRGDVLWJARJLHS-UHFFFAOYSA-N 283.291 2.489 5 50 CEBA O=[N+]([O-])c1cc(F)c(N2CCOCC2)cc1N1CCCC1 4182331 INSIUOQJUOAQHP-UHFFFAOYSA-N 295.314 2.171 5 50 CEBA COc1cc(O)c2c(=O)c3cc(O)ccc3oc2c1 4098527 XOXYHGOIRWABTC-UHFFFAOYSA-N 258.229 2.366 5 50 CEBA endogenous,in-man C[N@+]12CCC[C@H]3[C@H]4CCCC(=O)N4C[C@@H](CCC1)[C@H]32 253389770 AVTHDTNSRLXBOV-HEBKJCSOSA-N 263.405 2.016 5 50 CEBA biogenic CCOC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)on1 6350433 SSOVVOHZUNJEAK-UHFFFAOYSA-N 262.221 2.427 5 50 CEBA in-vitro Cc1cccnc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 445470 BSELUVKXUAJCLS-UHFFFAOYSA-N 271.276 2.479 5 50 CEBA O=[N+]([O-])c1cccc(CS(=O)(=O)c2cccc(O)c2)c1 183994863 SURFDCFEMCKNTH-UHFFFAOYSA-N 293.300 2.274 5 50 CEBA CCn1cc(C(=O)O)c(=O)c([N+](=O)[O-])c1-c1ccccc1 2490767 NTDSAVQYXWZJRP-UHFFFAOYSA-N 288.259 2.142 5 50 CEBA O=c1c2ccc([N+](=O)[O-])cc2ncn1CCCCCF 242292509 YMWKVKXWWCJJGC-UHFFFAOYSA-N 279.271 2.445 5 50 CEBA C[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 19607168 PDCWUKWDEMRFTJ-GHMZBOCLSA-N 250.298 2.204 5 50 CEBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCSC1=S 256153 PWTXCYNQGVBMDJ-UHFFFAOYSA-N 268.319 2.069 5 50 CEBA O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc([N+](=O)[O-])cc1 295797 JQSICWFXCJVSBV-UHFFFAOYSA-N 298.258 2.017 5 50 CEBA Nc1ccc(Cc2ccc(N)cc2[N+](=O)[O-])c([N+](=O)[O-])c1 1309609 KENYTAOVAUETRB-UHFFFAOYSA-N 288.263 2.258 5 50 CEBA biogenic Cc1cn([C@H](C)C(=O)N2CCCCCC2)nc1[N+](=O)[O-] 281207596 PXDPEYWWUREFIN-LLVKDONJSA-N 280.328 2.063 5 50 CEBA O=C(Nc1ccc(O)c([N+](=O)[O-])c1)[C@H]1C[C@@H]1c1cccnc1 170599967 NIJCUOWZCXJWNH-NEPJUHHUSA-N 299.286 2.438 5 50 CEBA CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(c1ncc(C)cc1[N+](=O)[O-])C[C@@H]3C2 286501630 YHUAYXJMPJFGEY-NARNDRFESA-N 289.335 2.158 5 50 CEBA CN(C)[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C12CCC2 585118031 VBEWEWPLHWPEJD-NEPJUHHUSA-N 276.340 2.275 5 50 CEBA COC(=O)c1cccc2c([N+](=O)[O-])ccc(C(=O)OC)c12 289478 PLUSAHPLSLMZSA-UHFFFAOYSA-N 289.243 2.321 5 50 CEBA Cc1cc(=O)n2nc(-c3ccc([N+](=O)[O-])cc3)sc2n1 197429 NFNHCDXELDZACR-UHFFFAOYSA-N 288.288 2.035 5 50 CEBA Cc1cc(C(=O)N2CCC[C@H]([C@@H](C)N)C2)cc([N+](=O)[O-])c1 135237248 SXHCEVOZEOEIIK-NEPJUHHUSA-N 291.351 2.103 5 50 CEBA COC(C)(C)C[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1O 154745143 AUBGRFQJRLFMLG-SECBINFHSA-N 296.323 2.234 5 50 CEBA O=C(CCCn1cc([N+](=O)[O-])cn1)Nc1ccc(F)cc1 1062394 VFKIAVSHUHZXCK-UHFFFAOYSA-N 292.270 2.349 5 50 CEBA CCOC(=O)COc1ccc(Cl)cc1[N+](=O)[O-] 1684382 SJYJALCZSQLBEF-UHFFFAOYSA-N 259.645 2.190 5 50 CEBA O=c1oc2ccc([N+](=O)[O-])cc2cc1Br 1706206 CMASVHRZKKMZCX-UHFFFAOYSA-N 270.038 2.464 5 50 CEBA COC(=O)CCc1sc2c(c1[N+](=O)[O-])NC(=O)CCC2 4005745 QRWUSQQFQZBVMQ-UHFFFAOYSA-N 298.320 2.037 5 50 CEBA CCOC(=O)[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 55543907 GPLDOLMDLMVMEW-CYBMUJFWSA-N 292.335 2.370 5 50 CEBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CC=CC1 170604940 LPSNSKXHJKOHSG-UHFFFAOYSA-N 282.321 2.129 5 50 CEBA Cc1cnc(NC(=O)COc2ccc([N+](=O)[O-])cc2)s1 4750274 DREGWYASKISMJS-UHFFFAOYSA-N 293.304 2.377 5 50 CEBA O=C(NC[C@H]1CCCO1)c1cc(Cl)ccc1[N+](=O)[O-] 1403970 YEVFYDIJRNBWIG-SECBINFHSA-N 284.699 2.157 5 50 CEBA O=C1CCCN1c1ccc([N+](=O)[O-])cc1Br 95944573 AXEZVDYQQOXIJF-UHFFFAOYSA-N 285.097 2.484 5 50 CEBA Cc1ccc(C(=O)NCCCOC(C)C)cc1[N+](=O)[O-] 2851056 RQSSYELDOYKQAI-UHFFFAOYSA-N 280.324 2.448 5 50 CEBA O=c1c([N+](=O)[O-])c[nH]c2c(OC(F)F)cccc12 1772716113 QKYPGUYDLSWUMT-UHFFFAOYSA-N 256.164 2.038 5 50 CEBA CNc1c(Br)cnc(Cl)c1[N+](=O)[O-] 261508218 QNAXSBLDUKABIG-UHFFFAOYSA-N 266.482 2.447 5 50 CEBA CCCCOc1ccccc1[C@H]1NC(=O)CC[C@@H]1[N+](=O)[O-] 4152261 ATMZHVLDKMDMSD-SWLSCSKDSA-N 292.335 2.462 5 50 CEBA O=[N+]([O-])c1ccc2nc3ccc([N+](=O)[O-])cn3c2c1 1653333 YZTPFAASBUIUKE-UHFFFAOYSA-N 258.193 2.304 5 50 CEBA CC(C)[C@@H](Nc1sc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 5231021 LMBQXNOXQFXFJT-SSDOTTSWSA-N 289.269 2.086 5 50 CEBA CCc1ncc(CNc2sccc2[N+](=O)[O-])c(=N)[nH]1 1875289304 GJRKBVDIMDNUHS-UHFFFAOYSA-N 279.325 2.033 5 50 CEBA C[C@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@@H]1C 119130938 LRIHZGMSFLLNRM-DTWKUNHWSA-N 264.281 2.171 5 50 CEBA C[C@H]1CN(CCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 16488952 ADLSEZMBGVDYIG-TXEJJXNPSA-N 280.324 2.083 5 50 CEBA CCN1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 303072 MGGPLXVIIATQKG-UHFFFAOYSA-N 297.742 2.026 5 50 CEBA O=[N+]([O-])c1ccc(N2CC[C@](F)(CO)C2)c2ccncc12 253392811 GMOVHVQRNYOXOD-CQSZACIVSA-N 291.282 2.054 5 50 CEBA O=Cc1cc(N2CCC(F)(F)C2)ccc1[N+](=O)[O-] 169725299 DIIJONUZRIMAQA-UHFFFAOYSA-N 256.208 2.253 5 50 CEBA COC(=O)Cc1ccc(Br)cc1[N+](=O)[O-] 12471716 KHXUTOLCCFWPDH-UHFFFAOYSA-N 274.070 2.073 5 50 CEBA in-vitro O=C1CC[C@H]([N+](=O)[O-])[C@H](c2ccccc2Br)N1 90360 AWZHFUMNBBNKNS-ONGXEEELSA-N 299.124 2.046 5 50 CEBA Nc1nnc(-c2cc([N+](=O)[O-])ccc2Cl)s1 4237823 HZVGLCTWGVBGCN-UHFFFAOYSA-N 256.674 2.349 5 50 CEBA O=[N+]([O-])c1ccc(C2=N[C@@H]3C=CC=C[C@H]3N=C2)cc1 1848442346 CRZSRHJJWDYDSY-CHWSQXEVSA-N 253.261 2.332 5 50 CEBA CCCCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 5028148 AEDYXKMHIRCUGG-UHFFFAOYSA-N 272.326 2.063 5 50 CEBA O=C(NC[C@@H]1CCCO1)c1cc([N+](=O)[O-])ccc1Cl 311211 ODITUXZCDVCDMZ-VIFPVBQESA-N 284.699 2.157 5 50 CEBA Cc1ccccc1[C@H](O)Cn1nc([N+](=O)[O-])cc1C 170078236 WKOHGVDQNKYAAF-GFCCVEGCSA-N 261.281 2.142 5 50 CEBA COc1ccc(I)c([N+](=O)[O-])c1 1606074 JWZODIRSJJQOKY-UHFFFAOYSA-N 279.033 2.208 5 50 CEBA in-vitro O=C(CSc1ccc([N+](=O)[O-])cn1)N1CCCCC1 8997346 GHHHXFJZNHPIBO-UHFFFAOYSA-N 281.337 2.094 5 50 CEBA O=[N+]([O-])c1cc(CN2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3O2)cs1 408075649 ZENPIZUGTGMZGU-DDHJBXDOSA-N 280.349 2.266 5 50 CEBA O=[N+]([O-])c1cc(I)c2cn[nH]c2c1 14983231 KZRVGUJHPIGAIM-UHFFFAOYSA-N 289.032 2.076 5 50 CEBA CC(C)(O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 4655055 YPQLFJODEKMJEF-UHFFFAOYSA-N 292.213 2.323 5 50 CEBA world O=C(Nc1ccc(F)c([N+](=O)[O-])c1)Nc1ncccc1O 8645077 CTEXRDAGMIZMOF-UHFFFAOYSA-N 292.226 2.479 5 50 CEBA O=C(NCc1ccno1)c1cc(Cl)cc([N+](=O)[O-])c1 352108749 ZGYNXWICJLRHFR-UHFFFAOYSA-N 281.655 2.166 5 50 CEBA C[C@H](NC(=O)[C@H](C)n1cc([N+](=O)[O-])cn1)c1ccccc1 1423694 PVBFQRCGAKXSAU-QWRGUYRKSA-N 288.307 2.230 5 50 CEBA CN1CCCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 2490940 JVODLMPLVONPLT-UHFFFAOYSA-N 283.759 2.386 5 50 CEBA C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1nn(C)cc1O 1615003091 DDHAQANZYNPVRF-SSDOTTSWSA-N 280.259 2.346 5 50 CEBA O=C1C[C@@H](CNc2cccc(F)c2[N+](=O)[O-])CN1C1CC1 253423952 SRUPWKMSNPMJDS-VIFPVBQESA-N 293.298 2.157 5 50 CEBA CSC[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1N 170605142 GMNMIYIVIXWRBU-JTQLQIEISA-N 295.364 2.145 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NCC1CCS(=O)(=O)CC1 301849974 OUNOOAFABKYGAC-UHFFFAOYSA-N 298.364 2.140 5 50 CEBA C[C@@H](C(=O)NCc1ccccn1)c1ccc([N+](=O)[O-])cc1 471496 CPHHPBKPPFTMGG-LLVKDONJSA-N 285.303 2.410 5 50 CEBA CC1(C)NC(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O 115963065 DSCGJNJGTRIMHN-UHFFFAOYSA-N 297.698 2.079 5 50 CEBA CN(CC(=O)O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4051756 KNIKUGYZTHXKJS-UHFFFAOYSA-N 278.186 2.134 5 50 CEBA CCc1cn(CCOc2ccccc2[N+](=O)[O-])ccc1=O 1615586939 GMHCMAHTPQJRFR-UHFFFAOYSA-N 288.303 2.398 5 50 CEBA Cc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c(O)n1 348122308 UEIPICBJWUSFQX-UHFFFAOYSA-N 287.275 2.185 5 50 CEBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccccn1 5906030 RGWGCGFUCXDATD-UHFFFAOYSA-N 261.212 2.381 5 50 CEBA Cc1noc(C)c1Cn1cc([N+](=O)[O-])c(C2CC2)n1 195046686 BVKTVABTFJLVPA-UHFFFAOYSA-N 262.269 2.322 5 50 CEBA O=[N+]([O-])c1ccc(OCCCCn2cncn2)cc1 2845334 ODQWRJUFLZLQBW-UHFFFAOYSA-N 262.269 2.046 5 50 CEBA C[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)CCS1 253432883 PJWCFKRELFSVJX-VIFPVBQESA-N 253.327 2.322 5 50 CEBA Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)COC2 181303050 ASEIBOVQJDNGEN-UHFFFAOYSA-N 299.286 2.460 5 50 CEBA CN(CCc1ccccn1)c1ccc([N+](=O)[O-])cn1 19640412 YOFCTPKITVHUQL-UHFFFAOYSA-N 258.281 2.064 5 50 CEBA O=C(Nc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CCCO1 473367 ZNVQSDFEEBDVNZ-SNVBAGLBSA-N 270.672 2.366 5 50 CEBA O=c1oc(-c2ccc([N+](=O)[O-])cc2)nc2ccc(O)cc12 613989 WQJHISQILHXRNW-UHFFFAOYSA-N 284.227 2.469 5 50 CEBA C[C@@H]1CN(C(=S)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 616361 JGODMJVGEVEKRU-NXEZZACHSA-N 280.349 2.380 5 50 CEBA Cc1cc(C(=O)N[C@@H](C)[C@H]2CCCO2)ccc1[N+](=O)[O-] 1056286 UQFFUXZXOBEKGG-GXFFZTMASA-N 278.308 2.201 5 50 CEBA O=[N+]([O-])c1cccc([C@@]2(O)COc3ccccc3O2)c1 1515352 QLENPVPCJPGPLZ-CQSZACIVSA-N 273.244 2.211 5 50 CEBA NCc1c(-c2ccc([N+](=O)[O-])cc2)nc2ccccn12 4243493 HGYQXEVFCRAMBS-UHFFFAOYSA-N 268.276 2.368 5 50 CEBA CN(C)CCOC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 4583078 KEJRKQHCLQMGBS-UHFFFAOYSA-N 287.703 2.358 5 50 CEBA CCc1c(Cl)nc2c([N+](=O)[O-])cc(C)cn2c1=O 725245179 QXAZDNXHRYPMJJ-UHFFFAOYSA-N 267.672 2.127 5 50 CEBA O=C(O)[C@@H]1CCCC[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 233251 WLUJSGQJOUITAU-VXGBXAGGSA-N 292.291 2.424 5 50 CEBA COc1ccc(CN(C)[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] 241409006 NDTWQEMKGFYQRQ-GXTWGEPZSA-N 294.351 2.339 5 50 CEBA O=[N+]([O-])c1ccc(O)c(NS(=O)(=O)c2ccccc2)c1 4635983 IUHFQKRMPSUSEA-UHFFFAOYSA-N 294.288 2.101 5 50 CEBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@H]1C(F)F 864091480 XFMQCZRYOZMNKG-KWQFWETISA-N 299.277 2.261 5 50 CEBA C[C@H](Nc1ccc([N+](=O)[O-])cn1)[C@H](O)Cc1ccccc1 120644577 VSNNRMRJOHMCLC-SMDDNHRTSA-N 287.319 2.394 5 50 CEBA C[N+](C)(C)[C@@H]1[C@H]2CC[C@H]3[C@@H]2[C@@H]2[C@@H]1CC[C@H]2[C@@H]3[N+](C)(C)C 257356189 GRVSLICFPDXWRA-AEJWVRLDSA-N 278.484 2.448 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1C[C@H](C)O 155728076 ZKTHFXFTMDTZRU-RYUDHWBXSA-N 292.335 2.279 5 50 CEBA COc1ccc(CCn2cccc([N+](=O)[O-])c2=O)cc1 161680840 UFXVFLSKPFTZSF-UHFFFAOYSA-N 274.276 2.008 5 50 CEBA Cc1cc(C(=O)N[C@H](C)[C@H]2CCCO2)ccc1[N+](=O)[O-] 1056288 UQFFUXZXOBEKGG-ZWNOBZJWSA-N 278.308 2.201 5 50 CEBA Nc1ccc(Oc2ccnc(N)c2[N+](=O)[O-])cc1F 143956512 CIZQBFOSWFQZTN-UHFFFAOYSA-N 264.216 2.086 5 50 CEBA CO[C@@H](CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(C)(C)C 164842350 GDCFEECHUGKWKK-LBPRGKRZSA-N 296.323 2.091 5 50 CEBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1[C@@H]1C[C@H]2CC[C@H]1C2 101589137 IKFDTAHCCFDZSJ-MWODSPESSA-N 286.287 2.379 5 50 CEBA COC(=O)c1cc([N+](=O)[O-])cc(Br)c1C 14983112 KHYSOGYKNCNXIS-UHFFFAOYSA-N 274.070 2.452 5 50 CEBA Cc1ccc(S(=O)(=O)N2CCC(C)CC2)c([N+](=O)[O-])c1 2862642 COHYHHYKQNHPKC-UHFFFAOYSA-N 298.364 2.324 5 50 CEBA O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1C[C@H]2C=C[C@H]1C2 125874629 RQKXTMNEPKLLQR-GVXVVHGQSA-N 272.304 2.423 5 50 CEBA CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC(=O)CC 5065649 NUSMIGBAMSUBSG-UHFFFAOYSA-N 266.253 2.259 5 50 CEBA O=[N+]([O-])c1ccc(OCCCN2CCCC2)cc1 2880428 JQLAYZSNLAOKEW-UHFFFAOYSA-N 250.298 2.460 5 50 CEBA O=[N+]([O-])c1ccc(N2CCOCC3(CCCC3)C2)nc1 240551442 GTTMPCHGODMZPT-UHFFFAOYSA-N 277.324 2.387 5 50 CEBA C[C@H](CC(=O)O)CC(=O)Nc1cccc([N+](=O)[O-])c1 2828420 FCXVVGUGQCTEBB-QMMMGPOBSA-N 266.253 2.034 5 50 CEBA CN(Cc1cn2c(n1)CCCC2)c1ncc([N+](=O)[O-])s1 253394819 FCCMSZHNNQVEAR-UHFFFAOYSA-N 293.352 2.221 5 50 CEBA O=[N+]([O-])c1cc2nccnc2cc1Br 155714 BPMUIFQVTOCTEL-UHFFFAOYSA-N 254.043 2.301 5 50 CEBA O=C(Nc1ccc([N+](=O)[O-])cn1)c1ccccc1F 4881682 UECPCVPPHQJPEM-UHFFFAOYSA-N 261.212 2.381 5 50 CEBA CCOc1cc(CC(=O)OC)c([N+](=O)[O-])cc1OCC 8253517 FQRZEYZOKRJWNG-UHFFFAOYSA-N 283.280 2.108 5 50 CEBA Cc1ccnc(NC2CC(c3ncc[nH]3)C2)c1[N+](=O)[O-] 1776006188 SDODXPWOFUTOMV-UHFFFAOYSA-N 273.296 2.379 5 50 CEBA Cc1cn([C@@H](C)C(=O)N2CCCCCC2)nc1[N+](=O)[O-] 281207603 PXDPEYWWUREFIN-NSHDSACASA-N 280.328 2.063 5 50 CEBA CCC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 268593999 VHLOEYINWGIWLQ-LBPRGKRZSA-N 277.324 2.326 5 50 CEBA CN(C)CC1CN(c2ccc(Cl)cc2[N+](=O)[O-])C1 408522163 DYWCQZZSBZXSLS-UHFFFAOYSA-N 269.732 2.246 5 50 CEBA C[C@@H](CNc1ncc([N+](=O)[O-])s1)CC1(C)OCCO1 192461748 MKOVXVBGHMVUDU-MRVPVSSYSA-N 287.341 2.252 5 50 CEBA COC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 438564 MTEJXFRLEHIBJZ-UHFFFAOYSA-N 290.231 2.227 5 50 CEBA O=C1Cc2ccccc2[C@H](c2ccc([N+](=O)[O-])cc2)N1 439783 WMHPIFSNJWOQCZ-HNNXBMFYSA-N 268.272 2.357 5 50 CEBA C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)C1 4905008 YJYYBEHVKIASSE-GHMZBOCLSA-N 298.364 2.261 5 50 CEBA Cc1cn([C@@H]2CCCc3cccnc32)nc1[N+](=O)[O-] 1875279035 VEUXGJJQCYVEHT-LLVKDONJSA-N 258.281 2.420 5 50 CEBA COc1ccc(OC)c(NC(=O)c2ccc([N+](=O)[O-])o2)c1 259769 TUBXKLDMCKTLFR-UHFFFAOYSA-N 292.247 2.457 5 50 CEBA O=c1[nH]nc(O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc12 267343 GIJPQCKPHUFJBW-UHFFFAOYSA-N 299.242 2.329 5 50 CEBA CCOC(=O)c1nc2ccc(Cl)cn2c1[N+](=O)[O-] 4003202 KFNXUMFGJGBRGO-UHFFFAOYSA-N 269.644 2.073 5 50 CEBA O=[N+]([O-])c1cccc(CN2CCCC[C@H]2c2nc[nH]n2)c1 121703251 SSXZQSCROVNPSD-ZDUSSCGKSA-N 287.323 2.440 5 50 CEBA C=CC(=O)OC[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1 6022202 HCVPUFHAWIINEQ-ZDUSSCGKSA-N 276.292 2.293 5 50 CEBA CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1Cl 15020371 VMNMZVKEDHEOEJ-UHFFFAOYSA-N 265.052 2.473 5 50 CEBA in-vitro Cc1ccc(C)c(NC(=O)Cn2c([N+](=O)[O-])cnc2C)c1 267863 JFBOUOPKLKBFGA-UHFFFAOYSA-N 288.307 2.355 5 50 CEBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@@H]2OCCC[C@H]21 253355439 AZIFUXWYXGWMCM-LOWVWBTDSA-N 290.319 2.201 5 50 CEBA C[S@](=O)C1(CNc2ccc(F)cc2[N+](=O)[O-])CCC1 253432959 QEEJQYFBSQWYCH-IBGZPJMESA-N 286.328 2.447 5 50 CEBA O=[N+]([O-])c1c(N2CCC(O)CC2)ccc2ncccc12 38537276 SHUXRLNHGBRMPN-UHFFFAOYSA-N 273.292 2.104 5 50 CEBA in-vitro O=c1c2ccccc2ncn1Cc1ccc([N+](=O)[O-])cc1 579122 ZXLFDIQHDOEBIQ-UHFFFAOYSA-N 281.271 2.353 5 50 CEBA Cc1cc([N+](=O)[O-])c(N2C[C@@H](C)O[C@H](C)C2)c([N+](=O)[O-])c1 4054652 NNDMGZJKWCOVPF-NXEZZACHSA-N 295.295 2.425 5 50 CEBA CCOC(=O)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F 4599242 JKGDBADNXWVYEW-UHFFFAOYSA-N 284.243 2.016 5 50 CEBA Cc1cc([N+](=O)[O-])cc(I)c1N 22001280 DFWFGNCVGITLCM-UHFFFAOYSA-N 278.049 2.090 5 50 CEBA CCn1c(S)nnc1-c1ccc([N+](=O)[O-])cc1 5686875 JNZXGFSUVHHLKG-UHFFFAOYSA-N 250.283 2.162 5 50 CEBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1ccccc1O 285184 LXXSKZBRHCUVEA-UHFFFAOYSA-N 284.227 2.101 5 50 CEBA Cc1ccc([N+](=O)[O-])c(N2CCc3ccnc(N)c3C2)c1 952991623 CITCJRRAHQVNLL-UHFFFAOYSA-N 284.319 2.443 5 50 CEBA Cc1cn([C@@H](C)c2cncc(F)c2)nc1[N+](=O)[O-] 888095962 LAQHYQRCDUNPFA-QMMMGPOBSA-N 250.233 2.243 5 50 CEBA O=[N+]([O-])c1cc(CN2CCC(O)CC2)ccc1Cl 239514 XRMBICQCVHCFTM-UHFFFAOYSA-N 270.716 2.205 5 50 CEBA COc1cc([N+](=O)[O-])c(OC)cc1N1C[C@@H](C)O[C@H](C)C1 5211487 MJQZFWSVTOFJOB-NXEZZACHSA-N 296.323 2.226 5 50 CEBA COCC(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 148288 LDTGCYGZKXQZTL-UHFFFAOYSA-N 293.304 2.303 5 50 CEBA Cc1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1Cl 1058994 WYYSRIBYYBLQOZ-UHFFFAOYSA-N 294.698 2.392 5 50 CEBA CC(C)(C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1776074 KCZDERJVEZZOKP-UHFFFAOYSA-N 267.241 2.031 5 50 CEBA N[C@@H]1CC[C@@H]2CN(Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]21 221870438 FQXVZVWNLNTZOY-NQBHXWOUSA-N 295.770 2.417 5 50 CEBA Cc1c(CC(=O)OC2CSC2)cccc1[N+](=O)[O-] 952848640 DFYLHTFDKPSKOB-UHFFFAOYSA-N 267.306 2.104 5 50 CEBA Cn1nc2cc([N+](=O)[O-])ccc2c1Br 28540367 RQSRFUOTGACRJJ-UHFFFAOYSA-N 256.059 2.244 5 50 CEBA Cc1ccc(NC(=O)C23CCC(CC2)N3)cc1[N+](=O)[O-] 911907143 SUPUZKPCJYKFKR-UHFFFAOYSA-N 275.308 2.126 5 50 CEBA C[C@H](C(=O)Nc1cccc(F)c1)n1cc([N+](=O)[O-])cn1 1423701 CPDSRQGKBPVGKX-MRVPVSSYSA-N 278.243 2.130 5 50 CEBA CCCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 4499275 UNMFDEKJSKZOEA-UHFFFAOYSA-N 295.314 2.183 5 50 CEBA Cn1cc([N+](=O)[O-])cc1C(=O)C(Cl)(Cl)Cl 2511040 WASYNLWEPOHNBM-UHFFFAOYSA-N 271.487 2.486 5 50 CEBA in-vitro O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccco1 365743 BQWBYRHFUKSQJB-UHFFFAOYSA-N 260.249 2.047 5 50 CEBA Nc1cc(I)c(Cl)cc1[N+](=O)[O-] 575720723 RQNHDVICHHABKH-UHFFFAOYSA-N 298.467 2.435 5 50 CEBA CCOC(=O)C(C)(C)Oc1ccc([N+](=O)[O-])cc1 16989290 WCXNETDTQPCZQA-UHFFFAOYSA-N 253.254 2.315 5 50 CEBA O=[N+]([O-])c1ccc(NCn2nnc3ccccc32)cc1 3877931 WBOWNVSDFCLQMH-UHFFFAOYSA-N 269.264 2.409 5 50 CEBA O=[N+]([O-])c1cccc(CN2CCCC[C@@H]2c2nc[nH]n2)c1 121703085 SSXZQSCROVNPSD-CYBMUJFWSA-N 287.323 2.440 5 50 CEBA CCN(CC)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 3885245 PQUNWYHOMQGOAT-UHFFFAOYSA-N 292.744 2.279 5 50 CEBA in-vitro COc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 259765 GMDLNQKNDFFWBU-UHFFFAOYSA-N 262.221 2.449 5 50 CEBA O=c1c2ccccc2ncn1-c1ccc([N+](=O)[O-])cc1 3121717 RMHYEHAOFXFUIY-UHFFFAOYSA-N 267.244 2.294 5 50 CEBA CCOC(=O)COc1c(C)cc([N+](=O)[O-])cc1C 4782790 KBWRNQSLTNHOIF-UHFFFAOYSA-N 253.254 2.154 5 50 CEBA Cc1csc2c(-n3cc([N+](=O)[O-])cn3)ncnc12 195345045 MNRYVSNNAOXIKW-UHFFFAOYSA-N 261.266 2.094 5 50 CEBA C[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 19607171 PDCWUKWDEMRFTJ-QWRGUYRKSA-N 250.298 2.204 5 50 CEBA CCN1C(=O)c2cccc3cc([N+](=O)[O-])cc(c23)C1=O 4558911 ZUDBAWZMKQSUGL-UHFFFAOYSA-N 270.244 2.364 5 50 CEBA Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC=CCC1 170593224 XQWFNOKMQZGMSF-SECBINFHSA-N 261.281 2.016 5 50 CEBA Nc1nnc(SCc2ccc([N+](=O)[O-])cc2)s1 17173784 BRHQRTARBDMZRP-UHFFFAOYSA-N 268.323 2.321 5 50 CEBA COC[C@@H](C)NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 456803 LGSSWAVKQJFAOY-SSDOTTSWSA-N 272.688 2.013 5 50 CEBA O=[N+]([O-])c1ncn(Cc2cccc(C(F)(F)F)c2)n1 614348 HBFNQIGVECINRP-UHFFFAOYSA-N 272.186 2.253 5 50 CEBA CCCC[C@@H](N)C(=O)OCc1ccc([N+](=O)[O-])cc1 144746143 KWAQQQQEUUGAOJ-GFCCVEGCSA-N 266.297 2.156 5 50 CEBA CCOC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 95496133 XPGCSHFQVYOFRG-UHFFFAOYSA-N 250.254 2.346 5 50 CEBA CC[N@+]12CCC[C@@H]3CN4C(=O)CCC[C@H]4[C@@H](CCC1)[C@@H]32 252441087 FFXCRHHKJZTONF-LAVBSDLTSA-N 277.432 2.406 5 50 CEBA biogenic COc1ccc(NC(=O)c2ccncc2)c([N+](=O)[O-])c1 4039103 JOVGZSBPOPXXFG-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA O=C(c1cc([N+](=O)[O-])c[nH]1)C(Cl)(Cl)Cl 2547585 XFHRTOGIBMVNEV-UHFFFAOYSA-N 257.460 2.476 5 50 CEBA CN1CCC(Nc2c(Cl)cncc2[N+](=O)[O-])CC1 310705312 CIQKTBJFGNHGDN-UHFFFAOYSA-N 270.720 2.149 5 50 CEBA O=c1c2c3n(c4ccccc4c(=O)n3c3ccccc13)CC2 266607 BWHHRKLHEQHRME-UHFFFAOYSA-N 288.306 2.324 5 50 CEBA COC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1 447752 ODJFMVUDWJDBPS-UHFFFAOYSA-N 284.318 2.470 5 50 CEBA CC[C@@](C)([N+](=O)[O-])S(=O)(=O)c1ccc(C)cc1 2141672 UGFUTGQMSZWXAV-NSHDSACASA-N 257.311 2.172 5 50 CEBA O=[N+]([O-])c1cc([N+](=O)[O-])c2cccnc2c1SCCO 2565394 JKUHFFSOJYWROE-UHFFFAOYSA-N 295.276 2.136 5 50 CEBA Cn1ncc([N+](=O)[O-])c1NC(=O)CSc1ccccc1 184414230 KNSIKHSVQNSONM-UHFFFAOYSA-N 292.320 2.059 5 50 CEBA CCOCCCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 2734672 XDCDDBSQOYJTPQ-UHFFFAOYSA-N 286.715 2.405 5 50 CEBA O=[N+]([O-])c1ccc(NCCO)c(C(F)(F)F)c1 4818891 CREYDPIGARYVFF-UHFFFAOYSA-N 250.176 2.018 5 50 CEBA C[C@H](O)CCN(C)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 139507953 CNUYOYROAIYGDE-QMMMGPOBSA-N 286.715 2.091 5 50 CEBA CCOC[C@H](O)COc1c(C)cc(Cl)cc1[N+](=O)[O-] 241371419 MNMBSOSNGFNFFH-JTQLQIEISA-N 289.715 2.333 5 50 CEBA Cc1nn(C(C)(C)C)c(=O)n1Cc1ccc([N+](=O)[O-])cc1 180397088 GSCYXQYULUNKRT-UHFFFAOYSA-N 290.323 2.065 5 50 CEBA Cc1ccc([C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])s1 170626984 HZBMORQXPWKPQK-VWYCJHECSA-N 280.349 2.385 5 50 CEBA CCOC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 3894112 PVRMTVXPYYOQRE-UHFFFAOYSA-N 297.286 2.012 5 50 CEBA Cn1cc(Cl)c(C(=O)OCc2ccc([N+](=O)[O-])cc2)n1 1072028 NLECLYFJQGHPSB-UHFFFAOYSA-N 295.682 2.339 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=S)N1CCCC1 5041186 CKIDSEOOOHWMPN-UHFFFAOYSA-N 281.337 2.396 5 50 CEBA COc1ccc2c3ccnc4ccc(=O)n(c2c1)c43 14445203 OWCRARVHWCCRAG-UHFFFAOYSA-N 250.257 2.447 5 50 CEBA biogenic,in-vitro O=[N+]([O-])c1cc2cn[nH]c2cc1N1CC[C@H](F)C1 1775987022 BPUDSEXYEMBGKT-QMMMGPOBSA-N 250.233 2.019 5 50 CEBA Cc1cc(C)c([N+](=O)[O-])c(N2CCOC[C@@H]2C2CC2)n1 408216695 VZMYXBCPCMYGAC-GFCCVEGCSA-N 277.324 2.222 5 50 CEBA O=C1c2ccccc2C(=O)N1Cc1ccc([N+](=O)[O-])cc1 1704331 QKWWUOQTLINZES-UHFFFAOYSA-N 282.255 2.391 5 50 CEBA in-vitro COc1cc([N+](=O)[O-])c(OC)cc1Br 8816541 BXOPAVIIEJMHQJ-UHFFFAOYSA-N 262.059 2.375 5 50 CEBA O=C(O)C12C[C@@H]3C[C@H](C1)CC(n1cc([N+](=O)[O-])cn1)(C3)C2 2731917 HYMOTMBSXZCHEU-XYAOECAESA-N 291.307 2.171 5 50 CEBA C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 4010546 AYPUWLHKVAJKHN-GHMZBOCLSA-N 298.364 2.261 5 50 CEBA O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1cc[nH]n1)CCC2 252507722 WSVNESACOYHIKS-CQSZACIVSA-N 272.308 2.485 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CC[C@H](O)CC1 241776917 RTMXTFZRUONBGO-UMSPYCQHSA-N 293.323 2.328 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1O 12617095 FXZGYEWQIGIFMC-UHFFFAOYSA-N 252.104 2.227 5 50 CEBA in-vitro O=[N+]([O-])c1cccc(-c2nnc3c(n2)CCCC3)c1 3108053 JTCRGZXURWGENX-UHFFFAOYSA-N 256.265 2.326 5 50 CEBA CC(C)(C)CNc1cc(N2CCNCC2)ccc1[N+](=O)[O-] 4703655 JOQNZYDQFZLBHC-UHFFFAOYSA-N 292.383 2.462 5 50 CEBA CC(C)[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)C(N)=O 225872370 YNHSKLLNUOBXSB-SNVBAGLBSA-N 271.704 2.170 5 50 CEBA Cc1cc(C)nc(N(C#N)Cc2cccc([N+](=O)[O-])c2)n1 469994 BEVSUXAXYHSDHU-UHFFFAOYSA-N 283.291 2.489 5 50 CEBA COC(=O)c1cc(Br)cc([N+](=O)[O-])c1OC 91297257 LNXQLOPQTUYEAM-UHFFFAOYSA-N 290.069 2.153 5 50 CEBA Cn1ncnc1SCc1nc2cc([N+](=O)[O-])ccc2o1 170594964 ZMGXELSNTMOMJT-UHFFFAOYSA-N 291.292 2.157 5 50 CEBA Cc1ccc([C@@H]2CC[N+]3(CCS(=O)(=O)CC3)C2)c(C)c1 1615610998 SYXMQCRMSHQNNH-OAHLLOKOSA-N 294.440 2.036 5 50 CEBA O=[N+]([O-])c1ccccc1OCCCCN1CCOCC1 19607432 PNNVRGKHCXCGOE-UHFFFAOYSA-N 280.324 2.086 5 50 CEBA O=C(O)[C@H]1CCCC[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 233254 WLUJSGQJOUITAU-NEPJUHHUSA-N 292.291 2.424 5 50 CEBA Cc1cc([N+](=O)[O-])nn1CCN(C)Cc1ccc(F)cc1 193876085 NIPOCWQZFXZWEX-UHFFFAOYSA-N 292.314 2.371 5 50 CEBA CSCc1nnc2sc(-c3ccc([N+](=O)[O-])o3)nn12 1776111030 OAAKFTYRVKJRKK-UHFFFAOYSA-N 297.321 2.217 5 50 CEBA COc1ccc(CSc2ncn[nH]2)cc1[N+](=O)[O-] 6556078 OSMQWVXTIPRLQU-UHFFFAOYSA-N 266.282 2.014 5 50 CEBA O=C(c1ccc([N+](=O)[O-])o1)N1CCc2ccccc21 235595 XGNYLISTMQLCKZ-UHFFFAOYSA-N 258.233 2.391 5 50 CEBA Cc1cccc(C(=O)NCc2ccco2)c1[N+](=O)[O-] 465478 SDQOOIITNSTVRT-UHFFFAOYSA-N 260.249 2.426 5 50 CEBA COC(=O)c1cnc(N2Cc3ccccc3C2)c([N+](=O)[O-])c1 225631848 YKYWKBMOJJRDQY-UHFFFAOYSA-N 299.286 2.297 5 50 CEBA CCN1CCCN(c2ccc([N+](=O)[O-])c(C)n2)[C@H](C)C1 408523763 NAAYGBMAEVKXHR-LLVKDONJSA-N 278.356 2.219 5 50 CEBA O=C(CN1CCCCC1)Nc1ccccc1[N+](=O)[O-] 4118188 MKFJZUXWIWRQSJ-UHFFFAOYSA-N 263.297 2.019 5 50 CEBA COc1ccc(NC(=O)c2cccnc2)cc1[N+](=O)[O-] 4841351 XHSFEQHTUGNOJF-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA O=[N+]([O-])c1cnc(N[C@@H]2C[C@H]3OCCC[C@@H]23)s1 253355680 GGUPPSVKOWSVLG-XLPZGREQSA-N 255.299 2.031 5 50 CEBA N[C@@H]1CC[C@H]2CN(Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]12 225363493 FQXVZVWNLNTZOY-GMXVVIOVSA-N 295.770 2.417 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccccc1 102600 FCYOCKBPAZXLKH-UHFFFAOYSA-N 292.316 2.073 5 50 CEBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)n1ccnc1 3091272 VSYATDVFSFDRKY-UHFFFAOYSA-N 250.189 2.011 5 50 CEBA CCCC(=O)NC(=S)Nc1ccccc1[N+](=O)[O-] 4754491 YAUHOGWECBULSS-UHFFFAOYSA-N 267.310 2.208 5 50 CEBA O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1C=C[C@H](CO)C1)CCC2 192966961 FULATJZLRXIPDV-NORZTCDRSA-N 288.347 2.499 5 50 CEBA CSc1ccccc1NC(=O)Cn1cc([N+](=O)[O-])cn1 1423776 DYEZUPUXYBEGPW-UHFFFAOYSA-N 292.320 2.152 5 50 CEBA O=C(O)c1ccc(COc2ccccc2[N+](=O)[O-])o1 373219 YHAVDXJFCAOEPJ-UHFFFAOYSA-N 263.205 2.465 5 50 CEBA Cc1ccc(CNCC2([S@](C)=O)CCC2)cc1[N+](=O)[O-] 280523511 BFWMPVLQXZQSIC-FQEVSTJZSA-N 296.392 2.294 5 50 CEBA O=C(CNc1ccncc1[N+](=O)[O-])c1ccccc1 230138524 UMYUGXHTXYJLNO-UHFFFAOYSA-N 257.249 2.285 5 50 CEBA Cc1cc(=NCCc2c[nH]c3ncccc23)[nH]cc1[N+](=O)[O-] 408513634 NZRNWQCLQJBVSV-UHFFFAOYSA-N 297.318 2.251 5 50 CEBA CCOC(=O)[C@@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 4978093 FQLARNHBJUNWLM-CYBMUJFWSA-N 292.335 2.370 5 50 CEBA CC(C)C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4763501 STMDPCBYJCIZOD-JTQLQIEISA-N 297.267 2.414 5 50 CEBA in-vitro CCSCCCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 225708813 WWXNMLLKNRZTHG-UHFFFAOYSA-N 298.364 2.476 5 50 CEBA Cc1cc([N+](=O)[O-])c(NCCCC(=O)O)c([N+](=O)[O-])c1 4054574 JKEBSNUAMSJFCL-UHFFFAOYSA-N 283.240 2.088 5 50 CEBA CCOC(=O)c1cc(NCCF)c(F)cc1[N+](=O)[O-] 725262031 SDFIAUZKCASNNA-UHFFFAOYSA-N 274.223 2.292 5 50 CEBA CCNc1ncc(Br)c(C)c1[N+](=O)[O-] 65337546 IBEKEYYPHDLMEP-UHFFFAOYSA-N 260.091 2.493 5 50 CEBA in-vitro O=[N+]([O-])c1ccc(/C=C2\[C@H](O)C3CCN2CC3)cc1 4833278 KWXOJIBUTPSKRN-KADHNRKRSA-N 260.293 2.022 5 50 CEBA Cc1ccc(CSc2n[nH]c(O)n2)cc1[N+](=O)[O-] 2325870185 MDOOONAMCPUNCI-UHFFFAOYSA-N 266.282 2.019 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H](CO)C1 4988916 VYUHYWOLTOTBRN-LVDDQXARSA-N 276.336 2.312 5 50 CEBA Cc1ccnc(NCC2([S@](C)=O)CCC2)c1[N+](=O)[O-] 280714130 IAWAXWYTBYYBIS-IBGZPJMESA-N 283.353 2.011 5 50 CEBA CCOC(=O)N(C)c1ccc(Cl)nc1[N+](=O)[O-] 231546422 ADDHMOVDMXAUPI-UHFFFAOYSA-N 259.649 2.236 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)Nc1cn[nH]c1 162609514 XXJPOKVWFRQRNL-UHFFFAOYSA-N 261.241 2.270 5 50 CEBA Cc1cc(-c2nn3cnnc3s2)ccc1[N+](=O)[O-] 4839840 SKRPKMFYVVHSBA-UHFFFAOYSA-N 261.266 2.069 5 50 CEBA Cc1ccc(CN[C@@H](C)C[C@@H](C)O)cc1[N+](=O)[O-] 228068490 GCLFEVMDWZLKTQ-WDEREUQCSA-N 252.314 2.152 5 50 CEBA O=Cc1ccc(S(=O)(=O)c2ccccc2)c([N+](=O)[O-])c1 584904526 LXLJQBNBTZIAPM-UHFFFAOYSA-N 291.284 2.240 5 50 CEBA CCOC(=O)c1cccc(/C=C/N(C)C)c1[N+](=O)[O-] 55421418 ZOFHVINNQRNSBB-CMDGGOBGSA-N 264.281 2.304 5 50 CEBA C[C@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](C)N1 3877883 CNBXACPESICDFY-DTORHVGOSA-N 269.732 2.435 5 50 CEBA Cc1cc([N+](=O)[O-])cnc1N1C[C@]2(C)CN(C)C[C@@]2(C)C1 585132659 JXPMZIAGKQEEKN-GJZGRUSLSA-N 290.367 2.076 5 50 CEBA O=[N+]([O-])CCc1ccc(COc2ccccn2)cc1 113991594 UVFYQHLOGAVQSP-UHFFFAOYSA-N 258.277 2.480 5 50 CEBA Nc1ncnc(NCCCc2ccccc2)c1[N+](=O)[O-] 3912538 CPLJOCBZTZQZFL-UHFFFAOYSA-N 273.296 2.012 5 50 CEBA O=C(Nc1cccnc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2900992 HXMSMNIVNBVIAT-UHFFFAOYSA-N 288.219 2.150 5 50 CEBA Cc1nn(CC(=O)c2ccccc2)c(C)c1[N+](=O)[O-] 124380 SGEQEUDWHQIDRM-UHFFFAOYSA-N 259.265 2.291 5 50 CEBA CC(=O)N1c2cc([N+](=O)[O-])ccc2N(C(C)=O)[C@H](C)[C@@H]1C 4769758 PMTHDUKCVRFGKD-BDAKNGLRSA-N 291.307 2.091 5 50 CEBA O=[N+]([O-])c1cccc(OCCCCN2CCOCC2)c1 20653125 IMUPCOPFTCOVCP-UHFFFAOYSA-N 280.324 2.086 5 50 CEBA Cc1n[nH]c(SCc2ccc([N+](=O)[O-])cc2)n1 5730076 MZTRDLUZHKQREO-UHFFFAOYSA-N 250.283 2.314 5 50 CEBA Cc1cc(N2Cc3c[nH]nc3C[C@H](C)C2)ncc1[N+](=O)[O-] 952994750 UTLRNDCRSCTDAD-VIFPVBQESA-N 287.323 2.220 5 50 CEBA Cc1cc(NCc2nc(C)c(C)[nH]2)ncc1[N+](=O)[O-] 952965233 ZUVNSFAMTRDPGW-UHFFFAOYSA-N 261.285 2.250 5 50 CEBA CCN(CC)C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 12411567 YKIUESJPNPVVLH-UHFFFAOYSA-N 282.296 2.094 5 50 CEBA Cc1ccnc(NCc2c(C)n[nH]c2C)c1[N+](=O)[O-] 301310280 ZEPCMXDIVRUEJX-UHFFFAOYSA-N 261.285 2.250 5 50 CEBA Cc1cc(I)cc([N+](=O)[O-])c1N 22001275 QDOSZZJIJPEKSP-UHFFFAOYSA-N 278.049 2.090 5 50 CEBA Cc1ncc(CN(C)Cc2ccccc2[N+](=O)[O-])cn1 339089616 DXDNDPNEUYLCLK-UHFFFAOYSA-N 272.308 2.325 5 50 CEBA O=C(NCc1ccccc1)c1cc(O)cc([N+](=O)[O-])c1 261493657 GQMZFTIFJSZLTO-UHFFFAOYSA-N 272.260 2.230 5 50 CEBA Cc1nc(Oc2cccc([N+](=O)[O-])c2C)nc(N(C)C)n1 488424941 SZIMWEYMINXXBX-UHFFFAOYSA-N 289.295 2.255 5 50 CEBA C[C@@H]1CN(c2ccc([N+](=O)[O-])c(Cl)n2)C[C@@H](C)O1 220972210 IQAPYMRQSUJETN-HTQZYQBOSA-N 271.704 2.257 5 50 CEBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cccnc1 255512 SHGXXRPUNRPJTO-UHFFFAOYSA-N 261.212 2.381 5 50 CEBA CC(C)C[C@H](CNCc1csc([N+](=O)[O-])c1)C(=O)O 263050168 KRWPPVUENMZGBX-SNVBAGLBSA-N 286.353 2.493 5 50 CEBA CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1NC(C)=O 137746687 BOOKYQWOGYGRJD-UHFFFAOYSA-N 271.660 2.165 5 50 CEBA O=[N+]([O-])c1cc(CN2C[C@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cs1 408075653 ZENPIZUGTGMZGU-WRWGMCAJSA-N 280.349 2.266 5 50 CEBA O=[N+]([O-])c1ccc(I)s1 1667547 IAHMSOROXQKFTN-UHFFFAOYSA-N 255.036 2.261 5 50 CEBA COc1ccc(C(=O)NCCCOC(C)C)cc1[N+](=O)[O-] 2876763 QAILVVSUZRXNKI-UHFFFAOYSA-N 296.323 2.148 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1C[C@@H]1C 123028341 CBZXGNGUWMHPPJ-XVKPBYJWSA-N 265.269 2.133 5 50 CEBA CC(Cl)(Cl)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1 166095253 NUGFHXOKLUBYHD-UHFFFAOYSA-N 279.079 2.433 5 50 CEBA CC(C)N(Cc1ccccc1)c1ncnc(N)c1[N+](=O)[O-] 3912622 VMFQGAUGJICSHV-UHFFFAOYSA-N 287.323 2.382 5 50 CEBA O=C(O)c1c([N+](=O)[O-])ccc(F)c1Br 116205033 WHOTUUFDHGVXSG-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA CCc1ncnc(Oc2ccc([N+](=O)[O-])c(CO)c2)c1F 408514625 BCRJRCVOQZGDRJ-UHFFFAOYSA-N 293.254 2.371 5 50 CEBA O=[N+]([O-])c1cc(I)cnc1Cl 1436092 PIJMRJPJERUFNI-UHFFFAOYSA-N 284.440 2.248 5 50 CEBA O=C1c2ccccc2C(=O)N1c1ccc([N+](=O)[O-])cc1 4015298 PHBJJKVNDZUAGC-UHFFFAOYSA-N 268.228 2.395 5 50 CEBA Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCOC1 314002313 JXWTYDIWMWWPKP-SNVBAGLBSA-N 296.298 2.199 5 50 CEBA O=[N+]([O-])c1ccc(N2CCN(Cc3ccccc3)CC2)nc1 4996185 JOIDIVUDKPRTIS-UHFFFAOYSA-N 298.346 2.312 5 50 CEBA C[C-]1NN=C2CCCCC[N+]2=C1c1ccc([N+](=O)[O-])cc1 71787237 TWPOFKRWTRAVPC-UHFFFAOYSA-N 286.335 2.439 5 50 CEBA Cc1nn(C[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1C 170608279 YHUSVNGNXWJGMB-CQSZACIVSA-N 275.308 2.450 5 50 CEBA CCC(=O)n1c(=O)sc2cc([N+](=O)[O-])ccc21 39997 CFVYLRNXNOMKLM-UHFFFAOYSA-N 252.251 2.021 5 50 CEBA CC[C@@H](C)NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 103441 SFNOVDGSBOWYQT-MRVPVSSYSA-N 252.270 2.132 5 50 CEBA Cc1ccc(NC(=O)Cn2nc([N+](=O)[O-])cc2C)cc1 1070253 NMKAKZARSFWNHL-UHFFFAOYSA-N 274.280 2.047 5 50 CEBA O=C1N[C@@H](c2ccccc2[N+](=O)[O-])Nc2ccccc21 2164684 WWONPPJDLHHUIW-ZDUSSCGKSA-N 269.260 2.449 5 50 CEBA CC1=CC[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2C1 100499292 QVYQESJGNYAWIR-QWHCGFSZSA-N 286.287 2.441 5 50 CEBA CC[C@@H](OC(=O)c1ccc([N+](=O)[O-])c(C)c1)C(=O)OC 120558466 AVDUUYBSMJTCJE-LLVKDONJSA-N 281.264 2.012 5 50 CEBA C[C@H]1[C@@H]2CCCN2CCN1Cc1cccc([N+](=O)[O-])c1 5032863 SGFDXMPBOGSZRP-WFASDCNBSA-N 275.352 2.263 5 50 CEBA CCC[C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 449776 MEPMUNSRBSAFTI-SNVBAGLBSA-N 250.298 2.442 5 50 CEBA Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2CCCCN2C1=O 328595200 NZNVIFVLUJHXNX-LLVKDONJSA-N 289.291 2.224 5 50 CEBA O=[N+]([O-])c1ccc(N2CCO[C@H](Cc3ccccc3)C2)nc1 271930416 WKFWGOAUHYQLKK-OAHLLOKOSA-N 299.330 2.438 5 50 CEBA CN(Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[C@H]1O 252725442 HUCWGHZBKBIZAQ-ZIAGYGMSSA-N 264.325 2.330 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCCCC2)cc1 146547 QMOYHHIPLJSTFQ-UHFFFAOYSA-N 284.337 2.160 5 50 CEBA O=C(OCc1cccc([N+](=O)[O-])c1)c1cccnc1 466969 XOFOFVXQHJCOFQ-UHFFFAOYSA-N 258.233 2.347 5 50 CEBA CC1=CC[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]2C1 4831968 QVYQESJGNYAWIR-STQMWFEESA-N 286.287 2.441 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2ccc(C(F)(F)F)cc2)N1 115985 LJCIZWPTTFFJTB-GXSJLCMTSA-N 288.225 2.302 5 50 CEBA CSc1ccc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 103402 KGPRPRLZOPUBMT-ZYHUDNBSSA-N 266.322 2.005 5 50 CEBA C[C@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)N1 3877884 CNBXACPESICDFY-IUCAKERBSA-N 269.732 2.435 5 50 CEBA CC(=O)C(Sc1ccc([N+](=O)[O-])cc1)C(C)=O 100384870 STQAWVPECAWACE-UHFFFAOYSA-N 253.279 2.234 5 50 CEBA Cc1cc([N+](=O)[O-])cc(Br)c1C(=O)O 306978223 OEZGSEGSWSTHCF-UHFFFAOYSA-N 260.043 2.364 5 50 CEBA Cc1cc(OCCN2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] 20167850 NHKYKIXKLYGSPU-CHWSQXEVSA-N 294.351 2.391 5 50 CEBA CCON(CC)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 866307244 VDKJITONGZTTSK-UHFFFAOYSA-N 255.230 2.281 5 50 CEBA O=c1c2cc([N+](=O)[O-])sc2ncn1Cc1ccccc1 1189300269 QTGBXNBLJREUQM-UHFFFAOYSA-N 287.300 2.415 5 50 CEBA C[C@H]1CCCCN1c1ncnc(Cl)c1[N+](=O)[O-] 5073584 FDZIHACRTHIXBA-ZETCQYMHSA-N 256.693 2.417 5 50 CEBA C[C@H](O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4035899 LXEWZOWSTQCFQZ-LURJTMIESA-N 264.203 2.406 5 50 CEBA Cc1ccc([C@@H]2CCCN2C(=O)[C@H]2C[C@H]2[N+](=O)[O-])s1 252585353 HZBMORQXPWKPQK-GARJFASQSA-N 280.349 2.385 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCCF 163034039 HOJLEKMVFIEZDQ-UHFFFAOYSA-N 255.249 2.384 5 50 CEBA O=C(Cn1cnc([N+](=O)[O-])n1)c1csc2ccccc12 194532502 FHUDHDPOBHKUBJ-UHFFFAOYSA-N 288.288 2.284 5 50 CEBA COC(=O)CCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 38653 QXVGJKZWIHSNNV-UHFFFAOYSA-N 286.671 2.140 5 50 CEBA O=[N+]([O-])Cc1nnc(C(F)(F)F)n1-c1ccccc1 1385203 CCWKAEQZEFAHKA-UHFFFAOYSA-N 272.186 2.063 5 50 CEBA Cc1cnc(OCC(=O)OC(C)(C)C)c([N+](=O)[O-])c1 175137742 WNFSGIWGBISRGV-UHFFFAOYSA-N 268.269 2.019 5 50 CEBA O=[N+]([O-])c1cc(F)ccc1N1C[C@@H](CO)CC12CCC2 2325789720 IUCLZJHTTHLFGD-JTQLQIEISA-N 280.299 2.475 5 50 CEBA O=C(O)[C@H]1CC=CC[C@@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 265990 RQDJQZJFPQXPPH-RYUDHWBXSA-N 290.275 2.200 5 50 CEBA O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccccc1CO 460686 UMKIWEIQMJPILI-UHFFFAOYSA-N 286.287 2.268 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccco1 4427694 KIIHCSPDCNPQON-UHFFFAOYSA-N 262.221 2.449 5 50 CEBA Nc1nnc(-c2ccc([N+](=O)[O-])cc2Cl)s1 3716776 MBKZCQZUHORQLK-UHFFFAOYSA-N 256.674 2.349 5 50 CEBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)cc1 4867603 INFDUIOBNKPERY-UHFFFAOYSA-N 280.671 2.083 5 50 CEBA Cc1ccnc(N[C@H]2C[C@H](C)N(C3CC3)C2)c1[N+](=O)[O-] 133551949 FGDPXEMIHPAZRY-QWRGUYRKSA-N 276.340 2.335 5 50 CEBA O=[N+]([O-])c1cc(Cl)ccc1N1CCCNCC1 3877859 KLZCNMVBZDWQIE-UHFFFAOYSA-N 255.705 2.048 5 50 CEBA CN1CCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 169804149 UGODOWJUTUIJLN-UHFFFAOYSA-N 298.730 2.028 5 50 CEBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1ccccc1 235609 HNNCFMUZZXJQLR-UHFFFAOYSA-N 268.228 2.395 5 50 CEBA in-vitro O=C(CCC1CCOCC1)Nc1ccc(O)c([N+](=O)[O-])c1 166093951 MQVKEFJPHQYACQ-UHFFFAOYSA-N 294.307 2.446 5 50 CEBA Cc1sc(CCCCC(=O)O)c(N)c1[N+](=O)[O-] 5276847 LYTHLEQGHLPJHK-UHFFFAOYSA-N 258.299 2.344 5 50 CEBA O=[N+]([O-])c1cnc(C(F)(F)F)cc1Nc1cnc[nH]1 225812097 XXWWPKCQSFAIJN-UHFFFAOYSA-N 273.174 2.475 5 50 CEBA Cc1c(-c2nn3cnnc3s2)cccc1[N+](=O)[O-] 4855772 UGHAWXRHAZMTBR-UHFFFAOYSA-N 261.266 2.069 5 50 CEBA CCN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 564220 NIFHWGGCHLNHHK-UHFFFAOYSA-N 297.742 2.026 5 50 CEBA Cc1ccc(F)cc1Nc1ncnc(N)c1[N+](=O)[O-] 3912586 DSCYTYWZBFIADC-UHFFFAOYSA-N 263.232 2.158 5 50 CEBA O=[N+]([O-])c1ccc(C2=N[C@H]3C=CC=C[C@@H]3N=C2)cc1 1848442349 CRZSRHJJWDYDSY-STQMWFEESA-N 253.261 2.332 5 50 CEBA O=[N+]([O-])c1cc(F)c(N2CCCC2)cc1N1CCOCC1 4182330 QLSFAENXXVSAHG-UHFFFAOYSA-N 295.314 2.171 5 50 CEBA O=C(Cc1ccc([N+](=O)[O-])cc1)c1c(O)cc(O)cc1O 523501 JFWOJRCRRTUMLR-UHFFFAOYSA-N 289.243 2.137 5 50 CEBA biogenic CCN(CC)CCCNC(=O)c1cccc([N+](=O)[O-])c1C 2743227 JRKVGUCRQADDKA-UHFFFAOYSA-N 293.367 2.365 5 50 CEBA C[C@@H]1CN(c2cc([N+](=O)[O-])ccc2Cl)C[C@@H](C)N1 228935 HZFONUHGJQMUKR-RKDXNWHRSA-N 269.732 2.435 5 50 CEBA O=[N+]([O-])c1ccc(-n2nccn2)cc1C(F)(F)F 585139503 FNHLKZNKVJCINB-UHFFFAOYSA-N 258.159 2.194 5 50 CEBA COCC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 170593209 FOYCMGWIHZDNPB-UHFFFAOYSA-N 278.186 2.199 5 50 CEBA CC(C)c1ccc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 107291 KAELMYGEWHEWBH-JSGCOSHPSA-N 262.309 2.406 5 50 CEBA Cc1nnc(NC(=O)c2cccc([N+](=O)[O-])c2)s1 291334 XRGKSSUMKQULIB-UHFFFAOYSA-N 264.266 2.007 5 50 CEBA Cc1cccc(N2CCC(n3cncn3)CC2)c1[N+](=O)[O-] 225459003 DIOIXPIBTRALTB-UHFFFAOYSA-N 287.323 2.336 5 50 CEBA Cc1ccnc(NC(=O)COc2ccccc2[N+](=O)[O-])c1 37868952 IREUHIHCURCHJV-UHFFFAOYSA-N 287.275 2.316 5 50 CEBA CN(c1ccc([N+](=O)[O-])cc1C(N)=O)C1CCCCC1 5064216 WGPLRVNDDSXWML-UHFFFAOYSA-N 277.324 2.463 5 50 CEBA O=C(Cn1cc([N+](=O)[O-])cn1)NC1CCCCCCC1 1000963 CHHOFCGFSSGTNE-UHFFFAOYSA-N 280.328 2.020 5 50 CEBA CCOC(=O)N1CCc2cc([N+](=O)[O-])ccc2C1 214474900 IEJSMEJIIUMQCQ-UHFFFAOYSA-N 250.254 2.109 5 50 CEBA O=[N+]([O-])c1cc(F)ccc1N1C[C@H](CO)CC12CCC2 2325789721 IUCLZJHTTHLFGD-SNVBAGLBSA-N 280.299 2.475 5 50 CEBA Cn1cnnc1SCc1ccc([N+](=O)[O-])cc1 40068 DOIWZLMEHVEISF-UHFFFAOYSA-N 250.283 2.016 5 50 CEBA CCOC(=O)CCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 3878916 CICHBUDMCYNBSO-UHFFFAOYSA-N 297.267 2.258 5 50 CEBA aggregator CCN1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 4988051 SLNGTTMFTBPUNW-FNORWQNLSA-N 275.352 2.246 5 50 CEBA CC(=O)Nc1ccc([N+](=O)[O-])c(Br)c1 3852454 VITVFULPBGHUKO-UHFFFAOYSA-N 259.059 2.316 5 50 CEBA biogenic COc1ccc(NC(=O)CN2CCCCC2)c([N+](=O)[O-])c1 4833082 AXHVWRYUBUPOEJ-UHFFFAOYSA-N 293.323 2.028 5 50 CEBA O=C(O)c1cc(-c2ccc(Cl)c([N+](=O)[O-])c2)[nH]n1 725264779 WBALHQMKQUGFDB-UHFFFAOYSA-N 267.628 2.337 5 50 CEBA O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 146803 JGBSDGVWGWUGED-UHFFFAOYSA-N 284.271 2.208 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCO 4300259 NJZCRXQWPNNJNB-UHFFFAOYSA-N 250.176 2.018 5 50 CEBA COC(=O)c1cc([N+](=O)[O-])cn(C[C@H](C)CC(C)C)c1=O 242048158 VTIQUIYPGWPQTP-SNVBAGLBSA-N 296.323 2.225 5 50 CEBA COc1cccc(NC[C@@](C)(O)C(F)(F)F)c1[N+](=O)[O-] 274578960 ACFFQEQNXOMEBO-SNVBAGLBSA-N 294.229 2.329 5 50 CEBA CC(C)(C)OC(=O)Oc1ccc(N)c([N+](=O)[O-])c1 95635047 GBHDRLLCJYKRJB-UHFFFAOYSA-N 254.242 2.491 5 50 CEBA in-vitro CC(C)C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4763505 STMDPCBYJCIZOD-SNVBAGLBSA-N 297.267 2.414 5 50 CEBA O=[N+]([O-])c1nc(-c2ccc(Br)cc2)n[nH]1 6667455 FFGBSYGOSYEELZ-UHFFFAOYSA-N 269.058 2.142 5 50 CEBA Cc1cnc(N2CC[C@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])c1 408427019 YNTSLSKKTHZTBP-RYUDHWBXSA-N 277.324 2.161 5 50 CEBA CC(=O)c1ccc(NC[C@H]2CC(C)=NO2)c([N+](=O)[O-])c1 408523752 VDCOADCVQIVTPR-LLVKDONJSA-N 277.280 2.374 5 50 CEBA O=[N+]([O-])c1cccnc1N[C@@H]1CCN2CCCC[C@@H]12 222685155 CNXZWCQTRAXEIF-MNOVXSKESA-N 262.313 2.029 5 50 CEBA Cc1ccc(NC(=O)Cn2cnc([N+](=O)[O-])c2)cc1C 823950 BAFKCFGMLVAWPH-UHFFFAOYSA-N 274.280 2.047 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCCC1 4833330 IFPDHMQLJBZYJD-UHFFFAOYSA-N 293.323 2.028 5 50 CEBA O=[N+]([O-])c1ccc(N2CCN(Cc3ccncc3)CC2)cc1 55292059 DIPRJQOYKSPXDD-UHFFFAOYSA-N 298.346 2.312 5 50 CEBA CCn1nc(C)c([N+](=O)[O-])c1C(=O)c1ccccc1 44125400 MSLWSFIYYHAOFB-UHFFFAOYSA-N 259.265 2.351 5 50 CEBA CC1=C[C@H]2C[C@H]1[C@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21 239038462 DGHBLVQCGKCDAG-GSVCSZOMSA-N 298.298 2.296 5 50 CEBA Cc1cc2ncc([N+](=O)[O-])n2cc1Br 38537213 YNWPOCXNUADNQD-UHFFFAOYSA-N 256.059 2.313 5 50 CEBA in-vitro C[C@@H]1C(=O)C(C)(C)C(=O)O[C@@H]1c1ccc([N+](=O)[O-])cc1 182544 LBIIJNHUKQSKIJ-KWQFWETISA-N 277.276 2.424 5 50 CEBA CCCCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 2831441 AUPLNFHMMUKXIX-UHFFFAOYSA-N 281.268 2.341 5 50 CEBA biogenic CN(C)Cc1cc(Br)ccc1[N+](=O)[O-] 95494789 LAWYJGKVKWMGIV-UHFFFAOYSA-N 259.103 2.419 5 50 CEBA COc1cc(O)c2c(=O)c3c(O)c(OC)ccc3oc2c1 6018929 PUECEVJMPDNNHT-UHFFFAOYSA-N 288.255 2.375 5 50 CEBA biogenic,in-vitro O=[N+]([O-])c1cnn(C[C@@H]2CCC[C@@H](C(F)(F)F)O2)c1 901457228 VAPBQVOONCJUQP-IUCAKERBSA-N 279.218 2.291 5 50 CEBA O=[N+]([O-])c1cccc(NCn2nnc3ccccc32)c1 47639 FSJMZFUALNDQSF-UHFFFAOYSA-N 269.264 2.409 5 50 CEBA Cc1cc(N2C[C@@H](C)N(C)C[C@H]2C)ccc1[N+](=O)[O-] 239667134 BPAKWQSJSPNXLU-VXGBXAGGSA-N 263.341 2.432 5 50 CEBA C[C@H](C(=O)Nc1ccc(F)c(F)c1)n1cc([N+](=O)[O-])cn1 1423779 FELBFAJQHMQABZ-SSDOTTSWSA-N 296.233 2.269 5 50 CEBA O=C1N[C@H](c2ccccc2[N+](=O)[O-])Nc2ccccc21 2164686 WWONPPJDLHHUIW-CYBMUJFWSA-N 269.260 2.449 5 50 CEBA Cc1ccc(OCCN2CCCC2)c([N+](=O)[O-])c1 4845511 PSDBXMQILRHOAL-UHFFFAOYSA-N 250.298 2.378 5 50 CEBA CN(C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cn1 113914860 SCPNQHRVFIKKJW-UHFFFAOYSA-N 253.258 2.361 5 50 CEBA Cc1ccc(OCCN2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 20167799 LPQPPEMRNGDHPA-STQMWFEESA-N 294.351 2.391 5 50 CEBA CCOC(=O)c1ccc([N+](=O)[O-])c(/C=C/N(C)C)c1 218991014 QKXFFXUYABCAKT-BQYQJAHWSA-N 264.281 2.304 5 50 CEBA O=C(CN1CCCCCC1)Nc1cccc([N+](=O)[O-])c1 5064839 BNJHNALRJNWBAY-UHFFFAOYSA-N 277.324 2.409 5 50 CEBA C[C@H]1CN(C(=S)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 616405 OTWDABUDFHHNRI-UWVGGRQHSA-N 280.349 2.380 5 50 CEBA CCOC(=O)c1nc(Cl)c2ccc([N+](=O)[O-])cc2n1 575322882 ULXQFXOZGSIKND-UHFFFAOYSA-N 281.655 2.368 5 50 CEBA CO[C@@H]1CCCC[C@H]1Nc1ncccc1[N+](=O)[O-] 266222987 IGAAPXVTLSJBSR-MWLCHTKSSA-N 251.286 2.359 5 50 CEBA O=C(Nc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCCOC1 1615553002 UDUJUJZMXMFBJQ-SSDOTTSWSA-N 286.234 2.238 5 50 CEBA O=[N+]([O-])c1cccc(F)c1I 21982376 XADPCRFTWLAXEV-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA in-vitro Cc1cc([N+](=O)[O-])cnc1NCc1ccc2[nH]c(=O)[nH]c2c1 242191444 XFNOXNSOXDPTHK-UHFFFAOYSA-N 299.290 2.080 5 50 CEBA Cc1nn(CC(=O)C(C)(C)C)c2ncc([N+](=O)[O-])cc12 598912138 GJXSVGNEMDGGFC-UHFFFAOYSA-N 276.296 2.263 5 50 CEBA COc1ccc([N+](=O)[O-])c(N2CCCO[C@H](C)C2)c1 266417059 RKUYAYYIJJRERU-SNVBAGLBSA-N 266.297 2.219 5 50 CEBA CCc1cnc(CNc2nccc(C)c2[N+](=O)[O-])[nH]1 719154091 PJCPCASFSJYKTB-UHFFFAOYSA-N 261.285 2.196 5 50 CEBA Cn1cnnc1SCc1ccccc1[N+](=O)[O-] 40067 WBLWFZNICSSJMF-UHFFFAOYSA-N 250.283 2.016 5 50 CEBA Cc1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])no1 456765 XPWAMWLXIVWWCH-UHFFFAOYSA-N 261.237 2.072 5 50 CEBA Cc1cccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)c1[N+](=O)[O-] 466045 JQQHBAMVTIZNBY-GHMZBOCLSA-N 278.308 2.153 5 50 CEBA Cc1cnc(N2CC[C@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 408427018 YNTSLSKKTHZTBP-NWDGAFQWSA-N 277.324 2.161 5 50 CEBA Cn1c(-c2cccc([N+](=O)[O-])c2)c[n+]2ccccc12 337643 BWZXKRKZZLFXRS-UHFFFAOYSA-N 254.269 2.339 5 50 CEBA O=C1C[C@@H](c2cccc([N+](=O)[O-])c2)Sc2nncn21 447597 MIASPDXXKQUDAV-VIFPVBQESA-N 276.277 2.064 5 50 CEBA O=C(c1cccc([N+](=O)[O-])c1)n1nnc2ccccc21 101752 MXXZHDYGAKNXLA-UHFFFAOYSA-N 268.232 2.028 5 50 CEBA Cc1cccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)n1 194922 OCVHWGRZTWOHBY-UHFFFAOYSA-N 283.243 2.099 5 50 CEBA O=C(NCCOc1ccccc1)c1cccc([N+](=O)[O-])c1 4869399 GVRKQIOMMSDQIS-UHFFFAOYSA-N 286.287 2.404 5 50 CEBA CCC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1C 4091592 JNUUZFXWGAIWOJ-UHFFFAOYSA-N 267.310 2.126 5 50 CEBA COC(=O)[C@H]1CC[C@@H](Nc2cccc(F)c2[N+](=O)[O-])C1 278606059 AUJCIKNRFJBHTM-DTWKUNHWSA-N 282.271 2.488 5 50 CEBA O=[N+]([O-])c1cccc2c1ccn2CCC1OCCO1 120250506 DGJOQPXBIPFVAY-UHFFFAOYSA-N 262.265 2.313 5 50 CEBA O=Cc1ccc(N2CCC(F)(F)C2)c([N+](=O)[O-])c1 169725248 OTRSNKVKGQFWCN-UHFFFAOYSA-N 256.208 2.253 5 50 CEBA CCc1nnc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)s1 4499657 ZPIOQJYURTYPGS-UHFFFAOYSA-N 292.320 2.190 5 50 CEBA O=c1ccn(-c2ccc(C(F)(F)F)cn2)cc1[N+](=O)[O-] 170608343 OMXFJPZMFJLRLA-UHFFFAOYSA-N 285.181 2.160 5 50 CEBA Cc1ccc([N+](=O)[O-])c(N2CCC(c3nc[nH]n3)CC2)c1 756126085 DEOBEEKSZZXIJJ-UHFFFAOYSA-N 287.323 2.405 5 50 CEBA CCOC(=O)c1c[nH]c2c(ccc3cccnc32)c1=O 5479201 YUPWGIFULUYTQG-UHFFFAOYSA-N 268.272 2.253 5 50 CEBA O=[N+]([O-])c1ccc(NS(=O)(=O)c2cccs2)cc1 4035976 BCRMJNJFECLOSL-UHFFFAOYSA-N 284.318 2.457 5 50 CEBA COC(=O)c1cc(C(=O)NC2CCCC2)cc([N+](=O)[O-])c1 60840 VXLVFUPTQHASJN-UHFFFAOYSA-N 292.291 2.054 5 50 CEBA O=CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 431925 YJBHQKZGDIWRLZ-AWEZNQCLSA-N 256.261 2.430 5 50 CEBA O=[N+]([O-])c1ccc(N[C@H](CO)Cc2nccs2)c(F)c1 1615587884 UJDUWQKKIHRSNB-QMMMGPOBSA-N 297.311 2.206 5 50 CEBA Nc1c([N+](=O)[O-])cc(Br)c(F)c1F 82046455 UEQDRXXHEPIYMV-UHFFFAOYSA-N 253.002 2.218 5 50 CEBA COc1cc([N+](=O)[O-])c(OC)cc1N1C[C@H](C)O[C@@H](C)C1 5211784 MJQZFWSVTOFJOB-UWVGGRQHSA-N 296.323 2.226 5 50 CEBA O=C(Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1C(=O)O 4596893 OMUPALOXANKWJW-NWDGAFQWSA-N 292.291 2.424 5 50 CEBA COc1cc(C(=O)NC(C)(C)C)c([N+](=O)[O-])cc1OC 445475 HADGLSLEXPETNL-UHFFFAOYSA-N 282.296 2.140 5 50 CEBA O=[N+]([O-])c1ccc(CSC2=NCCCN2)cc1 4916849 SWYGXOLZLJMTPI-UHFFFAOYSA-N 251.311 2.177 5 50 CEBA COCc1nc2oc3ccccc3c(=O)c2cc1C(=O)OC 1387316 UENANUSSLJFSAR-UHFFFAOYSA-N 299.282 2.274 5 50 CEBA COc1ccc(C=O)cc1Cn1cc(Cl)c([N+](=O)[O-])n1 2573205 FPUKYFGGQDBCGS-UHFFFAOYSA-N 295.682 2.314 5 50 CEBA O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCCC1 123361 VSDLHRMCAJKOTJ-UHFFFAOYSA-N 254.673 2.484 5 50 CEBA COC[C@H]1CCCN(c2ccc(N)cc2[N+](=O)[O-])C1 225820458 BCOJSWVDRMUTNH-JTQLQIEISA-N 265.313 2.040 5 50 CEBA CC(=O)c1c[nH]ccc1=NC(=O)c1ccc([N+](=O)[O-])c(C)c1 350761330 DQOJAYFGKLJZRC-UHFFFAOYSA-N 299.286 2.175 5 50 CEBA Cc1ccc([N+](=O)[O-])c(OCCC2OCCO2)c1 163543090 OKIXHLCTCHYPBF-UHFFFAOYSA-N 253.254 2.045 5 50 CEBA C[C@H]1CN(C(=S)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 13547396 OTWDABUDFHHNRI-AOOOYVTPSA-N 280.349 2.380 5 50 CEBA O=C1[C@@H]2CCCC[C@H]2C(=O)N1c1cccc([N+](=O)[O-])c1 16663418 LKICUDFVTNUZQZ-VXGBXAGGSA-N 274.276 2.274 5 50 CEBA C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)[C@@H](O)c1ccccc1)C2 169748283 WKWOJBUWWZTUQV-FZKCQIBNSA-N 290.383 2.033 5 50 CEBA Cc1nn([C@H](C)C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] 295432383 UYSUQXCRDRUTHS-JFGNBEQYSA-N 294.355 2.165 5 50 CEBA O=[N+]([O-])c1ccc(N2CCCCC2)cc1N1CCOCC1 3894081 GYNFYPPYBHQMAK-UHFFFAOYSA-N 291.351 2.422 5 50 CEBA O=C1CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc2N1 4311748 KJONHKAYOJNZEC-UHFFFAOYSA-N 281.271 2.384 5 50 CEBA world CN1CCN(c2ccc([N+](=O)[O-])cn2)[C@@H](c2ccccc2)C1 226902691 ADNDXXPCPCNSIC-OAHLLOKOSA-N 298.346 2.483 5 50 CEBA CN(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 16125205 PTTSRYCEMAFIIT-UHFFFAOYSA-N 273.086 2.059 5 50 CEBA in-vitro COc1ccc([N+](=O)[O-])cc1NC(=O)C(F)(F)F 306054 PECQEDFMEXTFMO-UHFFFAOYSA-N 264.159 2.104 5 50 CEBA O=C(COc1cccc([N+](=O)[O-])c1)Nc1nccs1 452313 HZPIHRTVDRKBRT-UHFFFAOYSA-N 279.277 2.069 5 50 CEBA CNc1nc(C)c([N+](=O)[O-])c(Nc2ccc(OC)cc2)n1 3880400 ZISKTVUQMCJSJH-UHFFFAOYSA-N 289.295 2.487 5 50 CEBA Cc1ccnc(N2CC[C@H](c3ncc[nH]3)C2)c1[N+](=O)[O-] 585092823 PLQKXFLTQXQOCN-JTQLQIEISA-N 273.296 2.015 5 50 CEBA C[C@@H]1C=CC[C@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]12 101697961 PBLZWGAYCWXFBV-OASPWFOLSA-N 286.287 2.296 5 50 CEBA CN1CCN(c2ccc([N+](=O)[O-])c3ccccc23)CC1 71771847 CJYXAGKLYGONDV-UHFFFAOYSA-N 271.320 2.500 5 50 CEBA O=[N+]([O-])c1ccc(CN2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3O2)c(F)c1 408143797 CHROCPDJEWRXTD-QHSBEEBCSA-N 292.310 2.343 5 50 CEBA N=C1NC(=O)/C(=C/c2cc([N+](=O)[O-])ccc2Cl)S1 16511836 SJLXFQXYCVYKEF-YWEYNIOJSA-N 283.696 2.387 5 50 CEBA CCC[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 442493 NCEYXYKIBWQTAY-VIFPVBQESA-N 272.326 2.062 5 50 CEBA O=C(Nc1ccc(O)c([N+](=O)[O-])c1)[C@@H]1C[C@H]1c1cccnc1 170599968 NIJCUOWZCXJWNH-NWDGAFQWSA-N 299.286 2.438 5 50 CEBA C[C@H]1C(=O)N(c2ccc([N+](=O)[O-])cc2)C(=O)N1C1CCC1 192414919 GEMVASKGALORAR-VIFPVBQESA-N 289.291 2.304 5 50 CEBA CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCCOCC1 192744841 JBPURSQCGIDVFQ-SNVBAGLBSA-N 268.317 2.101 5 50 CEBA CCCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1594512 FGIFCTOQWKVMBH-UHFFFAOYSA-N 267.241 2.033 5 50 CEBA COc1cc([N+](=O)[O-])ccc1I 1614563 RBFWMPRFYROKPI-UHFFFAOYSA-N 279.033 2.208 5 50 CEBA in-vitro O=C(Nc1nccc2c([N+](=O)[O-])cccc12)[C@H]1CCCO1 863947266 JKWGIHNVYLDRBA-GFCCVEGCSA-N 287.275 2.261 5 50 CEBA CCC(=O)N1CCN(c2cc(C)c([N+](=O)[O-])cc2F)CC1 3904568 HLRHISOSUOCVJB-UHFFFAOYSA-N 295.314 2.101 5 50 CEBA CCOc1ccc(CSC(=N)N)cc1[N+](=O)[O-] 4348618 SUBZWOAAYBCLAA-UHFFFAOYSA-N 255.299 2.120 5 50 CEBA CC(=O)c1cc(Br)cc([N+](=O)[O-])c1O 58218 CLNIBJASCGZXHH-UHFFFAOYSA-N 260.043 2.266 5 50 CEBA in-vitro Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1Cl 371085 NLVKHLPWUFNPFF-UHFFFAOYSA-N 294.698 2.392 5 50 CEBA CO[C@@H]1CN(c2cc(N)ccc2[N+](=O)[O-])CC[C@H]1C 249292507 PZSMCUDMKBDLPW-NOZJJQNGSA-N 265.313 2.038 5 50 CEBA O=C(c1cccc([N+](=O)[O-])c1)n1cc(Cl)cn1 37160 BKMXGSZQEWHCJH-UHFFFAOYSA-N 251.629 2.133 5 50 CEBA CC1(C)C[C@@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)C(=O)O1 171081 YYEKUCDAPYUORF-SECBINFHSA-N 292.291 2.265 5 50 CEBA CCCOc1ccc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 2479076 KVLKACSEXGPRLX-JSGCOSHPSA-N 278.308 2.072 5 50 CEBA CCn1nc(C)c([N+](=O)[O-])c1N1C[C@H](C)[C@@H](C)C1 280741625 OLHQMQQUJUFCOZ-IUCAKERBSA-N 252.318 2.212 5 50 CEBA O=[N+]([O-])c1ccsc1N1CCC[C@H](c2nnc(O)o2)C1 589597806 VDMWOPDUPWNRGW-ZETCQYMHSA-N 296.308 2.129 5 50 CEBA C[C@@H]1[C@H]2CCCN2CCN1Cc1cccc([N+](=O)[O-])c1 5032866 SGFDXMPBOGSZRP-IUODEOHRSA-N 275.352 2.263 5 50 CEBA Cc1cccc(C(=O)Nc2ccccc2C(N)=O)c1[N+](=O)[O-] 463334 OUAFNSSRCOAMTI-UHFFFAOYSA-N 299.286 2.254 5 50 CEBA O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H]2CC[C@H]1C2 101797723 RQTRIAQNWDLFFL-GVXVVHGQSA-N 274.320 2.442 5 50 CEBA O=[N+]([O-])c1ccc(N2CCC[C@H](O)C2)c2cccnc12 4132286 XBQLWNUMHOMSNL-JTQLQIEISA-N 273.292 2.104 5 50 CEBA O=c1nc2oc3ccc4ccccc4c3cc-2c(=O)[nH]1 227729 MTDQWAQZHVZRSS-UHFFFAOYSA-N 264.240 2.134 5 50 CEBA Cc1c([N+](=O)[O-])c(C(=O)N2[C@H](C)CCC[C@H]2C)nn1C 2777035 REDJHDPMXREFSY-RKDXNWHRSA-N 280.328 2.040 5 50 CEBA COC(=O)c1ccc(NCC2CC2)c([N+](=O)[O-])c1 145360532 CZDDBKGUAWGYIL-UHFFFAOYSA-N 250.254 2.203 5 50 CEBA COC(=O)Cc1cc(Br)c([N+](=O)[O-])cc1F 169794994 AUCLJEKVQWLWOJ-UHFFFAOYSA-N 292.060 2.212 5 50 CEBA Cc1cc(N2Cc3c[nH]nc3C[C@@H](C)C2)ncc1[N+](=O)[O-] 952994748 UTLRNDCRSCTDAD-SECBINFHSA-N 287.323 2.220 5 50 CEBA COC(=O)c1cc([N+](=O)[O-])ccc1Br 56674 VSEYYEKRZNRECT-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA Cc1ccc(C(=O)NCc2ccncc2)cc1[N+](=O)[O-] 272266 DRQZEYPCZQDYCA-UHFFFAOYSA-N 271.276 2.228 5 50 CEBA COC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 4185386 PACMVJMRAUYEKK-UHFFFAOYSA-N 264.281 2.372 5 50 CEBA O=C(O)CCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 4963904 XEXUQWCOQYIGQA-UHFFFAOYSA-N 272.644 2.052 5 50 CEBA Cc1nc(N2CCC(c3ncccn3)CC2)ccc1[N+](=O)[O-] 952993327 MVKCKFDQFTWHQJ-UHFFFAOYSA-N 299.334 2.472 5 50 CEBA COc1c(C(=O)O)cc(OC(F)(F)F)cc1[N+](=O)[O-] 670422887 YVECFTZEUVMOCW-UHFFFAOYSA-N 281.142 2.200 5 50 CEBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)OC[C@@H]1CCCO1 451542 OPZNMJNEAWBGBY-YBJDMEARSA-N 277.276 2.330 5 50 CEBA O=[N+]([O-])c1ccc(CN2C[C@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)c(F)c1 408143793 CHROCPDJEWRXTD-AYRXBEOTSA-N 292.310 2.343 5 50 CEBA CSc1nccn1C(=O)c1ccccc1[N+](=O)[O-] 72079 CQAPYACLBNEAAL-UHFFFAOYSA-N 263.278 2.202 5 50 CEBA COc1cc(C=O)c([N+](=O)[O-])c(Br)c1OC 2167912 MJJFQBHJHZNDIJ-UHFFFAOYSA-N 290.069 2.187 5 50 CEBA O=[N+]([O-])c1ccc(F)c(I)c1 15443766 XSFIPDPCQOJJFR-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA in-vitro CCn1ccc(COC(=O)c2ccc([N+](=O)[O-])s2)n1 844754953 RMLAXELBPLKJRY-UHFFFAOYSA-N 281.293 2.230 5 50 CEBA C[C@H]1CN(C(=S)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 616362 JGODMJVGEVEKRU-UWVGGRQHSA-N 280.349 2.380 5 50 CEBA Cc1nn(Cc2ccccc2C(=O)O)c(C)c1[N+](=O)[O-] 2507803 JXVWZWVFPOLJOL-UHFFFAOYSA-N 275.264 2.155 5 50 CEBA C[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N3CC[C@@H](C)C3)n2)C1 585092759 MQXXDFGQZSBDLL-GHMZBOCLSA-N 291.355 2.077 5 50 CEBA CSc1ccc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 103397 KGPRPRLZOPUBMT-CMPLNLGQSA-N 266.322 2.005 5 50 CEBA COc1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 188524 QPKJCZKYVLZMQX-UHFFFAOYSA-N 298.254 2.404 5 50 CEBA C[C@@H](CC(=O)O)CC(=O)Nc1cccc([N+](=O)[O-])c1 463827 FCXVVGUGQCTEBB-MRVPVSSYSA-N 266.253 2.034 5 50 CEBA CCC(C)(C)NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 620100 GPBVREGFDLKKCX-UHFFFAOYSA-N 294.307 2.300 5 50 CEBA Cc1nc(N2CC[C@@H](c3cnccn3)C2)ccc1[N+](=O)[O-] 1612966748 JXLQGTQXXNJCHS-LLVKDONJSA-N 285.307 2.082 5 50 CEBA Cc1ccc(Cl)cc1NC(=O)Cn1cc([N+](=O)[O-])cn1 1424773 UBUOJRNYUOAJFQ-UHFFFAOYSA-N 294.698 2.392 5 50 CEBA O=[N+]([O-])c1ccc2nc(N3CCN(C4CC4)CC3)ccc2c1 299311753 FHTNYBJOHYPCIL-UHFFFAOYSA-N 298.346 2.427 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)NC1(CO)CCCC1 170602956 BOAOPGBUFLOVOA-UHFFFAOYSA-N 293.323 2.330 5 50 CEBA C[C@@H](CO)CNC(=O)c1ccc(C(C)(C)C)cc1[N+](=O)[O-] 1875293211 GPUQYHAPBNNOFY-SNVBAGLBSA-N 294.351 2.251 5 50 CEBA CC(C)c1ccc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 107304 KAELMYGEWHEWBH-TZMCWYRMSA-N 262.309 2.406 5 50 CEBA O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCO1 4628478 VCSKHPYWQZSVEA-JTQLQIEISA-N 270.672 2.366 5 50 CEBA O=[N+]([O-])c1ccc2c(I)n[nH]c2c1 14983610 GZCGNGLOCQEDMT-UHFFFAOYSA-N 289.032 2.076 5 50 CEBA in-vitro CCC(=O)c1ccc(N2C[C@H](C)[C@H](CN)C2)c([N+](=O)[O-])c1 864586801 XUIQKUJUKXWJKH-CMPLNLGQSA-N 291.351 2.219 5 50 CEBA COc1cc(N(C)[C@@H]2CCCC[C@H]2O)ccc1[N+](=O)[O-] 170085555 CSBOZEUTGAVYAR-DGCLKSJQSA-N 280.324 2.343 5 50 CEBA Nc1nnc(SCC(=O)c2cccc([N+](=O)[O-])c2)s1 2347889 MRFAMWJDIFYHIV-UHFFFAOYSA-N 296.333 2.004 5 50 CEBA Cc1ccnc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 6302712 STHXLHMQCRCYPM-UHFFFAOYSA-N 293.304 2.099 5 50 CEBA CCOC(=O)c1cc(-n2cccn2)c(F)cc1[N+](=O)[O-] 90464283 QZAVUQIQAFBBIY-UHFFFAOYSA-N 279.227 2.096 5 50 CEBA in-vitro O=C(O)[C@H]1CCCC[C@@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 233252 WLUJSGQJOUITAU-RYUDHWBXSA-N 292.291 2.424 5 50 CEBA CC(C)(C)N(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3107408 RPZBVEGAKUDYFE-UHFFFAOYSA-N 255.230 2.497 5 50 CEBA C[C@@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](C)N1 3877885 CNBXACPESICDFY-RKDXNWHRSA-N 269.732 2.435 5 50 CEBA O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1ccccc1[N+](=O)[O-] 104324303 JHIYHOXVZRXRNS-DUBDDPSESA-N 298.298 2.296 5 50 CEBA C[Si](C)(C)[C@@]12[C@H]3[C@@H]4[C@@H]5C[C@H]3[C@]36O[C@]53[C@H](C[C@H]16)[C@@]42[N+](=O)[O-] 257356449 ICEFMYGKFMZPDE-INIIJTOESA-N 289.407 2.147 5 50 CEBA COc1ccc(C=O)cc1Cn1nc(C)c([N+](=O)[O-])c1C 35780 LGQORZMQGBSBIF-UHFFFAOYSA-N 289.291 2.278 5 50 CEBA C[C@@H]1CN(c2ccc([N+](=O)[O-])c3cccnc23)C[C@@H](C)N1 3877891 VUIFYXAJJLSBES-GHMZBOCLSA-N 286.335 2.330 5 50 CEBA Cc1ccc([N+](=O)[O-])c(OCCCCN2CCOCC2)c1 20653562 UULNAHRNZSWTHQ-UHFFFAOYSA-N 294.351 2.394 5 50 CEBA CC(C)OCCCn1cc([N+](=O)[O-])c(C2CC2)n1 195055346 GJSOENHIUMUSJY-UHFFFAOYSA-N 253.302 2.484 5 50 CEBA C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)C1 16247013 YJYYBEHVKIASSE-PHIMTYICSA-N 298.364 2.261 5 50 CEBA COC(=O)c1ccc(-c2cnnc3ccc([N+](=O)[O-])cc23)[nH]1 96032954 AMBNNYPEYCUHLO-UHFFFAOYSA-N 298.258 2.320 5 50 CEBA Cc1ccc(S(=O)(=O)NCCC(C)C)cc1[N+](=O)[O-] 5041493 WJJIVYUGNPDDGN-UHFFFAOYSA-N 286.353 2.228 5 50 CEBA COc1ccc(C(=O)NCCC(C)C)cc1[N+](=O)[O-] 441426 TYOAULJHNZZVAR-UHFFFAOYSA-N 266.297 2.379 5 50 CEBA CCn1cc(C(=O)O)c(=O)c2cc([N+](=O)[O-])c(Cl)cc21 494956 NSLLQPWMFULLDU-UHFFFAOYSA-N 296.666 2.281 5 50 CEBA CC1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 269164948 ZWALOFFRVQUNOU-UHFFFAOYSA-N 264.281 2.173 5 50 CEBA CCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 4819480 RKPDUJSRMRUTGX-UHFFFAOYSA-N 297.742 2.026 5 50 CEBA O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCCC1 70262941 IQYWDMVYHUTRJR-UHFFFAOYSA-N 252.245 2.360 5 50 CEBA CC[C@H](C(=O)O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 90414065 HCGPXJPXFRMKMP-ZETCQYMHSA-N 254.198 2.081 5 50 CEBA in-vitro Cc1cc([N+](=O)[O-])cnc1N1C[C@]2(C)CN(C)C[C@]2(C)C1 585132658 JXPMZIAGKQEEKN-GASCZTMLSA-N 290.367 2.076 5 50 CEBA O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccccn1 2846601 VZLAOZFWLRTVNX-UHFFFAOYSA-N 258.233 2.347 5 50 CEBA C[C@H]1CCN(c2ncc([N+](=O)[O-])c(N3CC[C@@H](C)C3)n2)C1 585092760 MQXXDFGQZSBDLL-MNOVXSKESA-N 291.355 2.077 5 50 CEBA O=[N+]([O-])c1cc(F)ccc1NC(=S)NC[C@@H]1CCCO1 5041982 WEDULJWLPLNTEX-VIFPVBQESA-N 299.327 2.199 5 50 CEBA Cc1ccc(C)c(NC(=O)Cn2ccc([N+](=O)[O-])n2)c1 1068500 YDTNNNRKPJRYON-UHFFFAOYSA-N 274.280 2.047 5 50 CEBA O=C(NCc1ccncc1)Nc1ccc([N+](=O)[O-])cc1 4706964 NLNXEPKQTBJUHD-UHFFFAOYSA-N 272.264 2.312 5 50 CEBA Cc1ccc(OCCCCN2CCOCC2)c([N+](=O)[O-])c1 20118107 PEZSEDFESGWTEY-UHFFFAOYSA-N 294.351 2.394 5 50 CEBA COC(=O)c1snc(-c2ccc([N+](=O)[O-])cc2)c1N 196985108 VOPYURVTVXSONG-UHFFFAOYSA-N 279.277 2.087 5 50 CEBA CCc1cnc(CNc2nc3sccn3c2[N+](=O)[O-])o1 170598730 OKUWOEQGYHNZIF-UHFFFAOYSA-N 293.308 2.467 5 50 CEBA Nc1nc(Cl)cc(NCCc2cccc([N+](=O)[O-])c2)n1 758276546 ZZHFQPPPHDCCNG-UHFFFAOYSA-N 293.714 2.275 5 50 CEBA COc1c(O)c(=O)n2c3ccccc3c3ccnc1c32 13482852 PGFKZUOYIFDMQJ-UHFFFAOYSA-N 266.256 2.153 5 50 CEBA biogenic,in-vitro Cn1cc([N+](=O)[O-])c(C(=O)NC2CCCCCCC2)n1 371543 CFMCSMWPWNUVOQ-UHFFFAOYSA-N 280.328 2.171 5 50 CEBA CCCCOc1ccccc1[C@@H]1NC(=O)CC[C@@H]1[N+](=O)[O-] 4152262 ATMZHVLDKMDMSD-WFASDCNBSA-N 292.335 2.462 5 50 CEBA CC[C@H](C)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 4700212 TWXPRMXUQHHGJM-LBPRGKRZSA-N 291.351 2.151 5 50 CEBA COc1cc(NCCn2ccnc2)c(F)cc1[N+](=O)[O-] 170595114 BFOGSKATSAJZIP-UHFFFAOYSA-N 280.259 2.051 5 50 CEBA O=[N+]([O-])c1cc(I)cc2[nH]ncc12 14983236 ZKYFPOXUPDVFCL-UHFFFAOYSA-N 289.032 2.076 5 50 CEBA CN(CCc1ccc([N+](=O)[O-])cc1)Cc1ccnn1C 348364671 FSYVLFBZNPGQNQ-UHFFFAOYSA-N 274.324 2.003 5 50 CEBA CCCOc1ccc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 2479082 KVLKACSEXGPRLX-OCCSQVGLSA-N 278.308 2.072 5 50 CEBA CCc1nnc2n1N=C(c1ccc([N+](=O)[O-])cc1)CS2 502597 ITADYLNLPMLBPQ-UHFFFAOYSA-N 289.320 2.107 5 50 CEBA Cc1nc([N+](=O)[O-])nn1C12CC3CC(CC(C3)C1)C2 4991898 XEBHQNDUVXQTBY-UHFFFAOYSA-N 262.313 2.420 5 50 CEBA Cc1nn([C@H](C)C(=O)N2CCCC[C@H]2C)cc1[N+](=O)[O-] 2776908 SSSYHYXDYDYNKC-MWLCHTKSSA-N 280.328 2.062 5 50 CEBA Cc1cc(N2Cc3cnn(C)c3C2)ccc1[N+](=O)[O-] 585132589 BJIDRCKCOROEMV-UHFFFAOYSA-N 258.281 2.157 5 50 CEBA C[C@H]1CN(C(=S)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 13153377 JGODMJVGEVEKRU-AOOOYVTPSA-N 280.349 2.380 5 50 CEBA O=C(O)c1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 59698544 GDBCQTKUSLDFRP-UHFFFAOYSA-N 251.116 2.192 5 50 CEBA in-vitro CCOc1cc(N)c([N+](=O)[O-])cc1Br 65336843 VZUYPQXQCGVAFU-UHFFFAOYSA-N 261.075 2.338 5 50 CEBA in-vitro Oc1cc2c3c(c1)c1cc4c(cc1c[n+]3CC2)OCO4 4023694 DFQOXFIPAAMFAU-UHFFFAOYSA-O 266.276 2.271 5 50 CEBA biogenic,in-vitro O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1cc[nH]n1)CCC2 252507721 WSVNESACOYHIKS-AWEZNQCLSA-N 272.308 2.485 5 50 CEBA Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)CCC2 2760978 OYJRWGUFASJSRJ-UHFFFAOYSA-N 286.291 2.069 5 50 CEBA COC(C)(C)C[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1O 154745032 AUBGRFQJRLFMLG-VIFPVBQESA-N 296.323 2.234 5 50 CEBA O=c1ccc([N+](=O)[O-])cn1C[C@@H]1CCC2(CCCC2)O1 170605489 QSPSWRNAJNESFZ-LBPRGKRZSA-N 278.308 2.248 5 50 CEBA CC(C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 4680856 LUIBIPOESJDLBW-UHFFFAOYSA-N 251.238 2.205 5 50 CEBA O=[N+]([O-])c1cccc([S@@](=O)CC[C@@H]2CCCO2)c1 888097695 YWFUDSBHUMCPRG-VOJFVSQTSA-N 269.322 2.272 5 50 CEBA CC1CCC(C)(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1 170600421 UTZYTTWIOGKFGK-UHFFFAOYSA-N 293.323 2.394 5 50 CEBA O=[N+]([O-])c1ncn(C23C[C@H]4C[C@@H](CC(Cl)(C4)C2)C3)n1 100500907 GIGZHXNRXCQFRR-CRRMYELQSA-N 282.731 2.473 5 50 CEBA COc1cccc2c(=O)c3cccc(C(=O)O)c3[nH]c12 22006222 ZDSRKZQRHDTJCK-UHFFFAOYSA-N 269.256 2.388 5 50 CEBA in-vitro O=[N+]([O-])c1cc2nc(C(F)(F)F)[nH]c2c2nsnc12 4010271 OOBCABYRIUZSIT-UHFFFAOYSA-N 289.198 2.495 5 50 CEBA CCOC(=O)Nc1cc(Br)cnc1[N+](=O)[O-] 196375576 FWQJNBFSNAEDGF-UHFFFAOYSA-N 290.073 2.321 5 50 CEBA C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ncc[nH]1 141322236 CESFTCJCUQJNOD-QMMMGPOBSA-N 275.268 2.201 5 50 CEBA O=[N+]([O-])c1ccc(Sc2ccc([N+](=O)[O-])cn2)nc1 1603056 FEXMVHNVTSLEAK-UHFFFAOYSA-N 278.249 2.444 5 50 CEBA O=C(OCCN1CCCCC1)c1ccc([N+](=O)[O-])cc1 4965049 HCSGKVOJKWHJEK-UHFFFAOYSA-N 278.308 2.238 5 50 CEBA O=c1c2cc([N+](=O)[O-])ccc2nc2n1CCCCC2 517876 YQEBFSMTFJJIKA-UHFFFAOYSA-N 259.265 2.031 5 50 CEBA biogenic Nc1ncnc(NCc2ccc(Cl)cc2)c1[N+](=O)[O-] 5064840 JEKVCPIAIGJHNI-UHFFFAOYSA-N 279.687 2.233 5 50 CEBA CC[N+](CC)(CC)CN1C(=O)c2ccccc2C1=O 392563 LVNICIPOPBSZHC-UHFFFAOYSA-N 261.345 2.117 5 50 CEBA C[N+]1(C)CCC[C@@H]1c1cc(Br)cnc1N 19760565 VRYZQXKLNLFTAI-SNVBAGLBSA-N 271.182 2.338 5 50 CEBA biogenic,in-vitro Cn1ccnc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 372183 WOOSCGLSDAQSBQ-UHFFFAOYSA-N 265.656 2.213 5 50 CEBA COc1c(O)ccc(CN2CCC=C(F)C2)c1[N+](=O)[O-] 585117289 XJGQOFVKLFMEJJ-UHFFFAOYSA-N 282.271 2.368 5 50 CEBA C[N+]1(C)[C@H]2COC[C@H]1CC(OCc1ccccc1)C2 101042398 SHDIMCIYIQAWCQ-HUUCEWRRSA-N 262.373 2.209 5 50 CEBA O=[N+]([O-])c1cnc(Nc2cnn(C[C@H]3CCCO3)c2)s1 253425135 AZWABRYXQFRIDA-SECBINFHSA-N 295.324 2.170 5 50 CEBA C[C@H](CC[N+](C)(C)C)OC(=O)[C@@H]1OCCc2ccccc21 220132964 VCKFCODGNHIGOS-CZUORRHYSA-N 292.399 2.328 5 50 CEBA CCOC(=O)[C@H](CC)Oc1ccccc1[N+](=O)[O-] 70242782 URCHNMFROJPJJA-JTQLQIEISA-N 253.254 2.315 5 50 CEBA CC(=O)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C 4008031 UDRQDZZEQCXFPF-VIFPVBQESA-N 297.742 2.305 5 50 CEBA CCN(CC)c1cccc(Oc2nc([N+](=O)[O-])nn2C)c1 527940 CEZAXAJIPICZPA-UHFFFAOYSA-N 291.311 2.362 5 50 CEBA O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCCC1 122344 WDBLKANQIMBLDU-UHFFFAOYSA-N 254.673 2.484 5 50 CEBA CCC(C)(C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 4740438 IMRXJJXVTMDDOS-UHFFFAOYSA-N 250.298 2.442 5 50 CEBA COC(=O)c1sc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2c1N 2100405 GERYALREBTVTQZ-UHFFFAOYSA-N 297.248 2.087 5 50 CEBA Cc1ccc([C@H](C)NC(=O)c2c([N+](=O)[O-])cnn2C)cc1 2764527 XWPKRGSNKNBFCQ-JTQLQIEISA-N 288.307 2.128 5 50 CEBA COc1ccc(I)c(F)c1[N+](=O)[O-] 1772575815 GHDGXGAUJBEAPZ-UHFFFAOYSA-N 297.023 2.347 5 50 CEBA Cc1nc(N2CC[C@@H](c3ncccn3)C2)ccc1[N+](=O)[O-] 952993412 NFSXDJPOBMXDOX-LLVKDONJSA-N 285.307 2.082 5 50 CEBA C[C@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 23115140 XIGGMEHFOAGNCY-PHIMTYICSA-N 250.298 2.204 5 50 CEBA CCC(=O)NC(=S)Nc1cc([N+](=O)[O-])ccc1Cl 456332 KUSPWCIDOHLMEG-UHFFFAOYSA-N 287.728 2.471 5 50 CEBA Cc1ccc(CN[C@H](C)C[C@H](C)O)cc1[N+](=O)[O-] 228068508 GCLFEVMDWZLKTQ-MNOVXSKESA-N 252.314 2.152 5 50 CEBA C[C@H]1CN(CCCOc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 20652802 OUVPJANJTOYHRA-STQMWFEESA-N 294.351 2.473 5 50 CEBA CCOC(=O)CCCc1nc2cc([N+](=O)[O-])ccc2n1C 22063437 VJVBGSJZBDBEIF-UHFFFAOYSA-N 291.307 2.367 5 50 CEBA in-vitro O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccccc1 618869 KYXLIHXITJCEKW-UHFFFAOYSA-N 281.271 2.353 5 50 CEBA CS(C)(=O)=NCCNc1ccc(Cl)cc1[N+](=O)[O-] 408518426 GWPBUNQPIMFAQP-UHFFFAOYSA-N 291.760 2.388 5 50 CEBA Cc1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1C 1059410 DSMQIDQKDAFUOV-UHFFFAOYSA-N 274.280 2.047 5 50 CEBA O=C(NC[C@@H]1CCCO1)c1cc(Cl)ccc1[N+](=O)[O-] 1403971 YEVFYDIJRNBWIG-VIFPVBQESA-N 284.699 2.157 5 50 CEBA CCO[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)[C@]12CCCO2 273471047 IHPCQMCUNCQYTO-OUCADQQQSA-N 293.323 2.128 5 50 CEBA C[C@H]1CCNC(=O)[C@@H]1Nc1ccc(Cl)cc1[N+](=O)[O-] 193519384 QABJXSMURHCCII-WRWORJQWSA-N 283.715 2.185 5 50 CEBA O=[N+]([O-])c1ccc(OCCNCc2ccco2)cc1 3001139 OOTPDXYPYJXOPS-UHFFFAOYSA-N 262.265 2.356 5 50 CEBA CS[C@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@H]1N(C)C 270667532 QLGJJNHTKZGXQJ-KGLIPLIRSA-N 295.408 2.072 5 50 CEBA O=[N+]([O-])c1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 2168616 KYUUZCUXYXNPFO-UHFFFAOYSA-N 252.104 2.402 5 50 CEBA O=[N+]([O-])c1ccc(F)cc1I 66325875 QKROTSNREAHREK-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA O=[N+]([O-])c1ccc(NC[C@@H]2CN3CCC2CC3)c(F)c1 1616036197 PKBWFEIISLYFGK-LLVKDONJSA-N 279.315 2.488 5 50 CEBA Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc(O)n1 120423872 FQUXEUHMRCHJCK-UHFFFAOYSA-N 273.248 2.256 5 50 CEBA COc1ccc(Br)c([N+](=O)[O-])c1[N+](=O)[O-] 98086931 XFWBPNPOHJWYAY-UHFFFAOYSA-N 277.030 2.274 5 50 CEBA O=[N+]([O-])c1ccc(I)cc1F 85223420 UVJQZMONVWFIHE-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA in-vitro O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccn1 4359732 CVHSNPPVGUHVPE-UHFFFAOYSA-N 273.248 2.007 5 50 CEBA Cc1c(C(=O)Nc2ccccc2C(N)=O)cccc1[N+](=O)[O-] 447723 HMWICSBWTXTOAZ-UHFFFAOYSA-N 299.286 2.254 5 50 CEBA Cc1ccc(OCCOCCn2ccnc2)c([N+](=O)[O-])c1 8311001 LCCAYEXADXUIBI-UHFFFAOYSA-N 291.307 2.195 5 50 CEBA Cc1nnc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)s1 9318813 IKEIPTKGMNYAAW-UHFFFAOYSA-N 278.293 2.315 5 50 CEBA CN1CCc2c(Br)ccc([N+](=O)[O-])c2C1 22006387 DXRCGGKIRYSZQP-UHFFFAOYSA-N 271.114 2.345 5 50 CEBA O=[N+]([O-])c1cc(Cl)ccc1CSc1nnc(O)[nH]1 194638038 JJVZEQKBXLVMPA-UHFFFAOYSA-N 286.700 2.364 5 50 CEBA CN1CCN(CCCCOc2cccc([N+](=O)[O-])c2)CC1 4842046 UDRUOXLRERGKJA-UHFFFAOYSA-N 293.367 2.001 5 50 CEBA C[C@H]1CN(CCCOc2ccccc2[N+](=O)[O-])C[C@H](C)O1 20167826 RBZBAAXMDDRYAU-STQMWFEESA-N 294.351 2.473 5 50 CEBA CS[C@@H](CO)[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(C)=O)c1 239653798 BLKDTGSSUPXNDP-OQPBUACISA-N 298.364 2.322 5 50 CEBA O=[N+]([O-])c1cnc(N2CCC[C@H](OCC3CC3)C2)s1 242164661 WWVAWRJQMCWNTM-JTQLQIEISA-N 283.353 2.447 5 50 CEBA Cc1nn([C@H](C)C(=O)N2CCCCCC2)c(C)c1[N+](=O)[O-] 2884909 OABMVQWSKKQOOH-GFCCVEGCSA-N 294.355 2.372 5 50 CEBA Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1[N+](=O)[O-] 2911465 MBHQZDPRZFXOGY-UHFFFAOYSA-N 262.225 2.306 5 50 CEBA O=[N+]([O-])c1cnc(NC2CC2)c(Br)c1 38537072 QHJNUSLJEIVEHR-UHFFFAOYSA-N 258.075 2.327 5 50 CEBA in-vitro COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])o1 253025 HRZSSHAYTLBRJB-UHFFFAOYSA-N 290.231 2.227 5 50 CEBA O=C1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 236047306 FQBLHIKQXUKJJJ-UHFFFAOYSA-N 254.673 2.418 5 50 CEBA Cc1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1[N+](=O)[O-] 245226863 PHFPBZYRWJMTEV-DUBDDPSESA-N 298.298 2.215 5 50 CEBA Cc1cccc(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)c1F 193825419 UIAKOBMICFUHFQ-UHFFFAOYSA-N 291.238 2.395 5 50 CEBA O=C(O)[C@@H]1CCCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1 4596891 OMUPALOXANKWJW-VXGBXAGGSA-N 292.291 2.424 5 50 CEBA O=C(O)c1nn(C2C3CC4CC(C3)CC2C4)cc1[N+](=O)[O-] 66324291 XFKAVEXMZMQGBI-UHFFFAOYSA-N 291.307 2.487 5 50 CEBA COc1ccc(C(=O)N2CCCCC2)cc1[N+](=O)[O-] 442190 GKLFMIQMRQAMRR-UHFFFAOYSA-N 264.281 2.230 5 50 CEBA C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 255471 QWUNRULDLDWOOC-RKDXNWHRSA-N 298.726 2.498 5 50 CEBA O=C(NCCOc1ccccc1)c1ccccc1[N+](=O)[O-] 2906017 MFEOMOJIUVBERO-UHFFFAOYSA-N 286.287 2.404 5 50 CEBA O=c1c2cc([N+](=O)[O-])ccc2ncn1-c1ccccc1 476275 MUYVFWMRDXLKLD-UHFFFAOYSA-N 267.244 2.294 5 50 CEBA O=[N+]([O-])c1ccc(N2CCCCC2)cc1NCCCO 4357386 JMISCTTVGWDARQ-UHFFFAOYSA-N 279.340 2.379 5 50 CEBA O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCO1 4628480 VCSKHPYWQZSVEA-SNVBAGLBSA-N 270.672 2.366 5 50 CEBA CC[C@H](CSC)Nc1cc(N)c([N+](=O)[O-])cn1 1330636788 DKJYZDZLCDDBNB-SSDOTTSWSA-N 256.331 2.126 5 50 CEBA C[C@H]1CN(CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 20652770 ADLSEZMBGVDYIG-RYUDHWBXSA-N 280.324 2.083 5 50 CEBA O=Cc1cc(OC(F)(F)F)cc([N+](=O)[O-])c1O 642886984 ADRGAMGAOGQURY-UHFFFAOYSA-N 251.116 2.012 5 50 CEBA Cc1ccnc(N2CC[C@@H](c3ncc[nH]3)C2)c1[N+](=O)[O-] 585092824 PLQKXFLTQXQOCN-SNVBAGLBSA-N 273.296 2.015 5 50 CEBA Nc1cccc([C@@H](C[N+](=O)[O-])O[C@H]2CCCCO2)c1 72446986 YYTFIBZARMMTFA-OLZOCXBDSA-N 266.297 2.130 5 50 CEBA CC[C@H](CO)NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C 191336511 ADFJZOZEPAKPAV-SNVBAGLBSA-N 281.312 2.104 5 50 CEBA O=c1[nH]c(O)nc(/C=C/c2ccccc2Cl)c1[N+](=O)[O-] 4020854 HJJZPRWWYDMMPQ-AATRIKPKSA-N 293.666 2.208 5 50 CEBA COc1cc(/C=C\[N+](=O)[O-])ccc1OCC(=O)OC(C)C 4842464 KODZHDHZKWNFBM-SREVYHEPSA-N 295.291 2.273 5 50 CEBA O=c1ccc([N+](=O)[O-])cn1C[C@H]1CCC2(CCCC2)O1 170605490 QSPSWRNAJNESFZ-GFCCVEGCSA-N 278.308 2.248 5 50 CEBA C[C@H]1CN(CCCOc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 13153566 RBZBAAXMDDRYAU-BETUJISGSA-N 294.351 2.473 5 50 CEBA COc1ccccc1NC(=O)c1ccc([N+](=O)[O-])o1 66734 LLOOKVFCLWDJAP-UHFFFAOYSA-N 262.221 2.449 5 50 CEBA O=C(NC1CCCCC1)c1cc(O)cc([N+](=O)[O-])c1 261493418 AQFRXYMWBIJTAF-UHFFFAOYSA-N 264.281 2.363 5 50 CEBA O=[N+]([O-])c1cnc(N[C@@H]2C[C@@H]3OCCC[C@@H]32)s1 192544417 GGUPPSVKOWSVLG-PRJMDXOYSA-N 255.299 2.031 5 50 CEBA Cc1cn(-c2cccc([N+](=O)[O-])c2)c(=O)n1CC1CC1 252492919 MXOYNZYEUBZVBM-UHFFFAOYSA-N 273.292 2.266 5 50 CEBA CCc1nccn1CCNc1cc(C)c([N+](=O)[O-])cn1 719659132 ILGDVGFQHFOKDD-UHFFFAOYSA-N 275.312 2.169 5 50 CEBA CC(=O)c1ccc(N2CC[C@@H](N(C)C)[C@@H]2C)c([N+](=O)[O-])c1 314851714 DPRRXNHTHZAVNC-GXFFZTMASA-N 291.351 2.326 5 50 CEBA CCOC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1 5196113 HJEKLTSBXFXIBD-UHFFFAOYSA-N 269.282 2.038 5 50 CEBA O=C(NCCc1ccncc1)Nc1ccc([N+](=O)[O-])cc1 4978546 QBKHCMPWQDKVCL-UHFFFAOYSA-N 286.291 2.354 5 50 CEBA COC(=O)c1cc([N+](=O)[O-])cn(C[C@@H](C)CC(C)C)c1=O 242048157 VTIQUIYPGWPQTP-JTQLQIEISA-N 296.323 2.225 5 50 CEBA CCCN(CCC)C[C@H](O)COc1ccc([N+](=O)[O-])cc1 2988678 PMQMBNQVHUERAZ-AWEZNQCLSA-N 296.367 2.457 5 50 CEBA CCC(=O)NC1CCN(c2ccccc2[N+](=O)[O-])CC1 952990440 LRJUWRFFEZWRAG-UHFFFAOYSA-N 277.324 2.090 5 50 CEBA Cc1nn(C)c(C(=O)Nc2ccc(F)cc2)c1[N+](=O)[O-] 371225 RDGAMLGUQHZGJH-UHFFFAOYSA-N 278.243 2.028 5 50 CEBA Cc1ccc(C(=O)NCc2ccccn2)cc1[N+](=O)[O-] 253004 YCRWHNHIARQJPE-UHFFFAOYSA-N 271.276 2.228 5 50 CEBA CN1C(=O)CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc21 3831205 GWUSZQUVEVMBPI-UHFFFAOYSA-N 295.298 2.409 5 50 CEBA biogenic,investigational Nc1ccc([N+](=O)[O-])c(N2C[C@H]3[C@H]4CC[C@@H](C4)[C@@H]32)c1 367166671 VGDFXRQXKNLHTQ-KJWJVKQFSA-N 259.309 2.412 5 50 CEBA CC(C)(C)OC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 98096550 MGTHQEFQFSKJPA-UHFFFAOYSA-N 296.327 2.363 5 50 CEBA in-vitro O=[N+]([O-])c1ccc(N2CCNCC2)c(C(F)(F)F)c1 4132887 KMGDPTUNJDHJFZ-UHFFFAOYSA-N 275.230 2.023 5 50 CEBA in-vitro Cc1ccc(C(=O)Nc2nncs2)cc1[N+](=O)[O-] 175573 DQDKPOUEEVWBCZ-UHFFFAOYSA-N 264.266 2.007 5 50 CEBA CCCC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1OC 4688085 POAJWRGYFZPLFE-UHFFFAOYSA-N 297.336 2.217 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N2C[C@@H]3[C@H]4CC[C@@H](C4)[C@H]32)c1 367166670 VGDFXRQXKNLHTQ-HFAYUQKSSA-N 259.309 2.412 5 50 CEBA Cc1cnn(C2CCN(c3ccc([N+](=O)[O-])cn3)CC2)c1 369274710 RKKZKIFZZSRDRC-UHFFFAOYSA-N 287.323 2.336 5 50 CEBA CCC(CC)NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 457239 QLTVHJFSFIEUCJ-UHFFFAOYSA-N 294.307 2.300 5 50 CEBA COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccnc1 255517 TVBAAUALRYLMGC-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(O)c1 618472 HWCXJMIOURBKSF-UHFFFAOYSA-N 288.259 2.318 5 50 CEBA O=[N+]([O-])c1ccccc1N1CCC[C@H]1c1nc[nH]n1 952881953 KUYNFWKBHPEZAN-NSHDSACASA-N 259.269 2.054 5 50 CEBA CCN1CCC[C@H](Nc2ccc([N+](=O)[O-])c(C)n2)C1 161532354 OCCGXNSDSBHNID-NSHDSACASA-N 264.329 2.194 5 50 CEBA C[C@@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CCN1 3998705 NECMVUPTUANASG-MRVPVSSYSA-N 255.705 2.046 5 50 CEBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)CCN1 3878504 CNROPYCGZCFWJI-MRVPVSSYSA-N 255.705 2.046 5 50 CEBA Cc1cc(=O)[nH]nc1-c1ccc(Cl)c([N+](=O)[O-])c1 4170131 MAIRTURTZSWKAR-UHFFFAOYSA-N 265.656 2.307 5 50 CEBA COc1cc(C(=O)O)c([N+](=O)[O-])cc1Br 261507168 GDRXHJGZRSVCBT-UHFFFAOYSA-N 276.042 2.064 5 50 CEBA CCOc1cc(NCC2(O)CCC2)ccc1[N+](=O)[O-] 135770833 WKIIRNBZPAGZNB-UHFFFAOYSA-N 266.297 2.320 5 50 CEBA NC(=O)c1ccccc1OCc1ccc([N+](=O)[O-])cc1 447969 IAAUIJNOZFFURW-UHFFFAOYSA-N 272.260 2.273 5 50 CEBA O=C(NCc1ccco1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1751695 ZHIQFBRCXPMETE-UHFFFAOYSA-N 291.219 2.026 5 50 CEBA CN1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 3894076 SKTYGQGYDUZEPT-UHFFFAOYSA-N 255.705 2.000 5 50 CEBA O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1ccccc1 5453409 QDHKHIPXXJILFR-UHFFFAOYSA-N 281.271 2.353 5 50 CEBA CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C 3877906 RYQKAFQKGCZPFR-VIFPVBQESA-N 297.742 2.305 5 50 CEBA O=[N+]([O-])c1ccc(CN2CCN(c3ccccn3)CC2)cc1 4838193 FYMDPGZZVPBIDF-UHFFFAOYSA-N 298.346 2.312 5 50 CEBA O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCCC1 113699773 RAAAWSPZIMCBBB-UHFFFAOYSA-N 252.245 2.360 5 50 CEBA CC[C@H](O)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1C 163139596 OVHXKGXRPPXLEN-NSHDSACASA-N 281.312 2.186 5 50 CEBA O=C([C@H]1CCCO1)N1CCCCc2cc([N+](=O)[O-])ccc21 585125092 GDWYIVFEXISING-CQSZACIVSA-N 290.319 2.443 5 50 CEBA COc1ccc(I)cc1[N+](=O)[O-] 12359073 WULXGCDMVLQZBT-UHFFFAOYSA-N 279.033 2.208 5 50 CEBA in-vitro COC(=O)Nc1nnc(-c2cccc([N+](=O)[O-])c2)s1 620154 WEPFGWZDQRLQIN-UHFFFAOYSA-N 280.265 2.292 5 50 CEBA C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 19607086 GGHVLSZFXJPAPS-QWRGUYRKSA-N 250.298 2.204 5 50 CEBA CCn1nc(C)c([N+](=O)[O-])c1N1C[C@@H](C)[C@@H](C)C1 280741623 OLHQMQQUJUFCOZ-DTORHVGOSA-N 252.318 2.212 5 50 CEBA CCN(CC)C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1OC 3877547 WODULAPBUODZHM-UHFFFAOYSA-N 295.339 2.151 5 50 CEBA COC12CC(C1)N(c1nc(C)c([N+](=O)[O-])cc1Cl)C2 2325799736 UWANMXJOJQDDPW-UHFFFAOYSA-N 283.715 2.319 5 50 CEBA C[N+]1(Cc2ccc(C(F)(F)F)o2)CCOCC1 670425659 XZXQKHSWBSPGLT-UHFFFAOYSA-N 250.240 2.275 5 50 CEBA Cc1onc(-c2ccc([N+](=O)[O-])s2)c1C(=O)O 675057555 IVIYEJAYSBVNKC-UHFFFAOYSA-N 254.223 2.318 5 50 CEBA Cc1cc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)no1 442314 XZOVRIZSTJBNMT-UHFFFAOYSA-N 261.237 2.452 5 50 CEBA Cc1nc(NCCc2ccns2)ccc1[N+](=O)[O-] 709868450 QMPRBUBFGDTKLY-UHFFFAOYSA-N 264.310 2.409 5 50 CEBA Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccc(F)cc1F 89776 AJXVXAHNXXJRNM-UHFFFAOYSA-N 296.233 2.017 5 50 CEBA C[C@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 13153584 WRAUOSVUGOEMOS-BETUJISGSA-N 294.351 2.473 5 50 CEBA O=[N+]([O-])c1ccnc2[nH]cc(I)c12 16678076 XLVXZIOZDIALSM-UHFFFAOYSA-N 289.032 2.076 5 50 CEBA in-vitro Cc1ccc(S(=O)(=O)N2CCCCCC2)c([N+](=O)[O-])c1 614014 SDAXCYDDOSPHID-UHFFFAOYSA-N 298.364 2.468 5 50 CEBA N[C@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4899546 GJHIOWXZFDVUKQ-CQSZACIVSA-N 285.303 2.103 5 50 CEBA COC(=O)c1ccc([N+](=O)[O-])c(OCC2CC2)c1 129834859 XJAGTAYJYBVTIH-UHFFFAOYSA-N 251.238 2.170 5 50 CEBA CC[C@H](C)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517597 PCZSORDQCDENOD-CPCISQLKSA-N 297.267 2.414 5 50 CEBA Cc1cccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)c1C 4809664 GJHDIIPLLIGLGD-UHFFFAOYSA-N 260.253 2.187 5 50 CEBA O=[N+]([O-])c1ccc(-c2nc(Cc3ccon3)no2)cc1 225595526 MSDGKGHKNBQFTK-UHFFFAOYSA-N 272.220 2.224 5 50 CEBA C[C@H]1[C@H](C)CCN1C[C@H](O)COc1ccccc1[N+](=O)[O-] 248470434 VCKWMKACUHPTIA-AGIUHOORSA-N 294.351 2.065 5 50 CEBA O=[N+]([O-])c1ccc(C2=N[C@@H]3C=CC=C[C@@H]3N=C2)cc1 1848442348 CRZSRHJJWDYDSY-QWHCGFSZSA-N 253.261 2.332 5 50 CEBA Cc1ccc(Oc2ncnc(N)c2[N+](=O)[O-])cc1C 3912750 MFLDPUIHFIRTOC-UHFFFAOYSA-N 260.253 2.376 5 50 CEBA Cc1cc(C)n(C(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1 2176477 NXXWWXJKCMHCQW-UHFFFAOYSA-N 290.235 2.005 5 50 CEBA COC(=O)COc1ccc2c(c1)oc(=O)c1ccccc12 42244 UUOVBLJTYHSWKS-UHFFFAOYSA-N 284.267 2.498 5 50 CEBA Cc1ccnc(N2CCN[C@H](c3ccccc3)C2)c1[N+](=O)[O-] 952880477 BMNAQAUQCWARJF-AWEZNQCLSA-N 298.346 2.449 5 50 CEBA CC(=O)c1cc(Br)c(O)c([N+](=O)[O-])c1 147040907 WLTQCPUBXLOJQM-UHFFFAOYSA-N 260.043 2.266 5 50 CEBA CN(CCCNc1ncccc1[N+](=O)[O-])c1ccccn1 952993629 IVIJTTKDKHGNMK-UHFFFAOYSA-N 287.323 2.323 5 50 CEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCCCC1 4844797 VJGJTAXDGIDBBZ-UHFFFAOYSA-N 298.364 2.468 5 50 CEBA O=C(/N=c1/[nH]c2ccccc2s1)c1ccc([N+](=O)[O-])o1 9015785 INEMNYHCDSBKGP-UHFFFAOYSA-N 289.272 2.472 5 50 CEBA CO[C@H]1CN(c2cc(N)ccc2[N+](=O)[O-])CC[C@H]1C 193523871 PZSMCUDMKBDLPW-RNCFNFMXSA-N 265.313 2.038 5 50 CEBA Cc1cc(NCc2n[nH]c(C)c2C)ncc1[N+](=O)[O-] 716490905 GAPAXLHZTKXHAY-UHFFFAOYSA-N 261.285 2.250 5 50 CEBA Cc1ccc(C)n1NC(=O)c1ccccc1[N+](=O)[O-] 608685 ABCXSRSYFDZPFT-UHFFFAOYSA-N 259.265 2.397 5 50 CEBA CSCCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 294740095 CFCMPKWITGPCOL-UHFFFAOYSA-N 266.322 2.237 5 50 CEBA CCN(Cc1ccoc1)C(=O)c1cc([N+](=O)[O-])ccc1N 170605008 HAJHVJMLYPOMTF-UHFFFAOYSA-N 289.291 2.432 5 50 CEBA Cc1cc(C(=O)Nc2ccc(C(N)=O)cc2)ccc1[N+](=O)[O-] 2950476 GKXRWNRDNNTRLZ-UHFFFAOYSA-N 299.286 2.254 5 50 CEBA CCNC(=O)CNc1c(Cl)cc([N+](=O)[O-])cc1Cl 120714357 PEUJVRSBHDPPTA-UHFFFAOYSA-N 292.122 2.450 5 50 CEBA O=C1c2ccccc2C(=O)N1OCc1ccccc1[N+](=O)[O-] 1397319 UCMHYRMMWUXXTF-UHFFFAOYSA-N 298.254 2.323 5 50 CEBA Cc1ccc2c(c1)C[N+]1(CCS(=O)(=O)CC1)C(C)(C)C2 1775988791 IUOVTHUEQUQANQ-UHFFFAOYSA-N 294.440 2.075 5 50 CEBA O=[N+]([O-])c1c(C2CC2)cc2c(c1[N+](=O)[O-])OCCO2 4957763 GMUHKPNBGFOCDH-UHFFFAOYSA-N 266.209 2.152 5 50 CEBA O=C(O)Cc1csc(-c2ccc([N+](=O)[O-])cc2)n1 36912301 LLDCXPMGPFNAEQ-UHFFFAOYSA-N 264.262 2.345 5 50 CEBA O=C1CCc2cc(Br)c([N+](=O)[O-])cc21 71257040 MUTOBVAOAKQKMD-UHFFFAOYSA-N 256.055 2.486 5 50 CEBA O=[N+]([O-])c1cccnc1N1CCN[C@@H](Cc2ccccc2)C1 1145117662 FBRQLKGRGBEBNF-AWEZNQCLSA-N 298.346 2.011 5 50 CEBA O=[N+]([O-])c1ccc(Cc2ccccn2)cc1[N+](=O)[O-] 5800751 UGKKIRQDCJVCPH-UHFFFAOYSA-N 259.221 2.489 5 50 CEBA CCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 287726 SHSCUNMCWXHKHX-UHFFFAOYSA-N 261.281 2.145 5 50 CEBA biogenic C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 4776682 MFOLKAPJNYBJFJ-NXEZZACHSA-N 279.296 2.236 5 50 CEBA O=C(Nc1ccc([N+](=O)[O-])cn1)c1ccc(F)cc1 5090793 XSKQXBPPWRNBKY-UHFFFAOYSA-N 261.212 2.381 5 50 CEBA CN1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 3877862 QJALYRKQDBXDOE-UHFFFAOYSA-N 255.705 2.000 5 50 CEBA C[C@@H]1CCCN(c2ccc3nonc3c2[N+](=O)[O-])C1 4010555 YXPABINOQSWFKV-MRVPVSSYSA-N 262.269 2.367 5 50 CEBA CC1(C)C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)CCO1 148581180 TZURVZDIPGGLKL-VIFPVBQESA-N 296.298 2.421 5 50 CEBA CC1=NO[C@@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 585119956 CGSOFRVQFSIZBE-SNVBAGLBSA-N 292.295 2.190 5 50 CEBA Cc1cc([N+](=O)[O-])cc(C)c1OCC(=O)N1CCCC1 4782601 GZTRLIQGWGMLJW-UHFFFAOYSA-N 278.308 2.213 5 50 CEBA Cc1[nH]cnc1Cc1noc(-c2ccc([N+](=O)[O-])cc2)n1 225597189 XYOVYIIEIRCJMK-UHFFFAOYSA-N 285.263 2.267 5 50 CEBA Cn1ccnc1[C@@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1 253394884 HCTXQBVKDRVJMW-SECBINFHSA-N 293.352 2.169 5 50 CEBA Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])o2)cc1 183332 SQYYJVWHHJKTSQ-UHFFFAOYSA-N 260.249 2.426 5 50 CEBA Cc1cc(C(=O)N2CCc3cnccc32)c(N)c([N+](=O)[O-])c1 121647515 CUPXLZAMRFBWKR-UHFFFAOYSA-N 298.302 2.083 5 50 CEBA CN(C)CC(=O)Nc1ccc2[nH]c(=O)c3ccccc3c2c1 8960 UYJZZVDLGDDTCL-UHFFFAOYSA-N 295.342 2.181 5 50 CEBA in-vivo Cc1cc(C(=O)O)c([N+](=O)[O-])cc1Br 216701245 WKLFXBXUSBBVQO-UHFFFAOYSA-N 260.043 2.364 5 50 CEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccnc1 36272 ZTYZUHJJPSWCKL-UHFFFAOYSA-N 273.248 2.007 5 50 CEBA CC1(C)COCCN1c1c(F)cc([N+](=O)[O-])cc1F 225535006 QSHODTXVBKYCDQ-UHFFFAOYSA-N 272.251 2.488 5 50 CEBA O=[N+]([O-])c1cccc([C@@H]2N(O)[C@H]3CCCC[C@H]3N2O)c1 828842390 PTWXTNYVTQSTRA-ITGUQSILSA-N 279.296 2.301 5 50 CEBA COCCCNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 2774384 NFCXYANSHVUSTA-UHFFFAOYSA-N 272.688 2.015 5 50 CEBA O=C(Nc1ccc(O)c([N+](=O)[O-])c1)c1ccc(F)cn1 166151104 ZRPGEBBVFQENQD-UHFFFAOYSA-N 277.211 2.087 5 50 CEBA C[C@@H]1CCCCN1[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])o1 248037914 ZTBCEXKBNRXGIN-GHMZBOCLSA-N 295.339 2.181 5 50 CEBA Cn1cc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 177999590 HRDOFENNIPRQLR-UHFFFAOYSA-N 286.335 2.493 5 50 CEBA O=c1c([N+](=O)[O-])c[nH]c2cc(OC(F)(F)F)ccc12 1857778009 GGMJCGDSGGPMSW-UHFFFAOYSA-N 274.154 2.335 5 50 CEBA CC(C)(C)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 4107737 PKNBNPFDINKGFX-UHFFFAOYSA-N 265.313 2.169 5 50 CEBA C[C@@H](Oc1ccc([N+](=O)[O-])cc1)c1ccnc2ncnn12 1401863 DVNSAJAEKMUPSC-SECBINFHSA-N 285.263 2.173 5 50 CEBA COC[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Cl 456759 UVGPSAXDGUQXQO-SSDOTTSWSA-N 272.688 2.013 5 50 CEBA O=[N+]([O-])c1ccc(Cn2nnnc2Oc2ccccc2)cc1 4806554 GYWUWANJVSZHHA-UHFFFAOYSA-N 297.274 2.422 5 50 CEBA O=c1cc(C(F)(F)F)[nH]n1-c1ccc([N+](=O)[O-])cc1 100782206 CWRUNTKWRFYRDC-UHFFFAOYSA-N 273.170 2.093 5 50 CEBA CCOCCNc1ncc(Br)cc1[N+](=O)[O-] 42371379 FCKDYOZYGDBJRZ-UHFFFAOYSA-N 290.117 2.201 5 50 CEBA in-vitro O=[N+]([O-])c1ccc(N2CCO[C@@H](Cc3ccccc3)C2)nc1 271930414 WKFWGOAUHYQLKK-HNNXBMFYSA-N 299.330 2.438 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1SC[C@H](O)CO 615892 ZVKVWGOPTNTEKZ-SSDOTTSWSA-N 297.254 2.059 5 50 CEBA CO[C@H](C)CCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1 166110956 VJJRGJXZDMCNTQ-MRVPVSSYSA-N 268.269 2.054 5 50 CEBA CC(C)C[C@H](NSc1ncccc1[N+](=O)[O-])C(=O)O 28631478 QCVUBDSGNDCAAO-QMMMGPOBSA-N 285.325 2.086 5 50 CEBA O=[N+]([O-])c1cccc(Cl)c1N1CCC(O)CC1 236475188 HKUQMVMJDRLOSA-UHFFFAOYSA-N 256.689 2.209 5 50 CEBA CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)[C@@]12CCCO2 273471046 IHPCQMCUNCQYTO-BZPMIXESSA-N 293.323 2.128 5 50 CEBA CN(Cn1nnc2ccccc21)c1ccc([N+](=O)[O-])cc1 5328811 GLZZISIVMIUSGM-UHFFFAOYSA-N 283.291 2.433 5 50 CEBA O=[N+]([O-])c1cc(F)cc(I)c1 1569421 MXPYCSFCKXSPAB-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA in-vitro O=C1[C@H]2CCCC[C@H]2C(=O)N1c1cccc([N+](=O)[O-])c1 100429103 LKICUDFVTNUZQZ-TXEJJXNPSA-N 274.276 2.274 5 50 CEBA O=C(O)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 36912302 OJZLDZSRCQQYFU-UHFFFAOYSA-N 264.262 2.345 5 50 CEBA COC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 116755961 TVEWRZPCGJDZIH-UHFFFAOYSA-N 274.070 2.073 5 50 CEBA O=c1[nH]c(/C=C/c2ccc(Cl)cc2)nc(O)c1[N+](=O)[O-] 15684983 CCXNXJQIFBUHEQ-ZZXKWVIFSA-N 293.666 2.208 5 50 CEBA O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCOCC1 189289 BKIUKKCYXXNBIP-UHFFFAOYSA-N 292.316 2.282 5 50 CEBA Cn1cnc([N+](=O)[O-])c1N1CCC12CCCCC2 1875264100 QLKQFKUVZXMAEK-UHFFFAOYSA-N 250.302 2.241 5 50 CEBA Cc1cnc(N2CC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 408427020 YNTSLSKKTHZTBP-VXGBXAGGSA-N 277.324 2.161 5 50 CEBA C[N+](C)(C)CCc1ccc(CC[N+](C)(C)C)cc1 1775971239 YJYCFNLSNGNKQS-UHFFFAOYSA-N 250.430 2.184 5 50 CEBA CC(C)(C)C(=O)NC(=S)Nc1ccccc1[N+](=O)[O-] 3953444 VZYNWSUMPDNIOF-UHFFFAOYSA-N 281.337 2.454 5 50 CEBA COc1ccc(-c2csc(N)n2)cc1[N+](=O)[O-] 173286 NEWCDELJIAHCGN-UHFFFAOYSA-N 251.267 2.309 5 50 CEBA biogenic Nc1ncnc(N2CCCc3ccccc32)c1[N+](=O)[O-] 3912660 OCCYJZSHTZUFRY-UHFFFAOYSA-N 271.280 2.051 5 50 CEBA O=[N+]([O-])c1cnc(NC2CCC(F)(F)CC2)nc1 389913452 CGEMSFWYSVENON-UHFFFAOYSA-N 258.228 2.375 5 50 CEBA O=C(O)[C@H]1CC=CC[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 265993 RQDJQZJFPQXPPH-NEPJUHHUSA-N 290.275 2.200 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H]1CO 4985399 HTLIFIOVEGAHAR-YIALFULDSA-N 262.309 2.065 5 50 CEBA C[C@@H](C(=O)NCc1cccnc1)c1ccc([N+](=O)[O-])cc1 471272 ODCUAQZUJMVWDW-LLVKDONJSA-N 285.303 2.410 5 50 CEBA O=c1c2ccccc2ncn1Cc1cccc([N+](=O)[O-])c1 171476 WYPJIUXTSWSOSL-UHFFFAOYSA-N 281.271 2.353 5 50 CEBA CCN1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 2862969 DAMOQIGCMQRNJO-UHFFFAOYSA-N 293.367 2.001 5 50 CEBA Nc1ncnc(Oc2cccc3cccnc23)c1[N+](=O)[O-] 3912717 LZDVMNBOJHUXRA-UHFFFAOYSA-N 283.247 2.308 5 50 CEBA Cc1c([N+](=O)[O-])c(C(=O)N2[C@@H](C)CCC[C@@H]2C)nn1C 2777034 REDJHDPMXREFSY-IUCAKERBSA-N 280.328 2.040 5 50 CEBA O=[N+]([O-])c1ccc(-c2nc(-c3ccncc3)no2)cc1O 170090346 RXYNOQWVLPTUBE-UHFFFAOYSA-N 284.231 2.412 5 50 CEBA O=C(NC1CC1)c1cc(Br)cc([N+](=O)[O-])c1 15021140 UUXXLHHAEOPFQK-UHFFFAOYSA-N 285.097 2.250 5 50 CEBA in-vitro CO[C@@H](C)CCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1 166110837 VJJRGJXZDMCNTQ-QMMMGPOBSA-N 268.269 2.054 5 50 CEBA O=[N+]([O-])c1cccc(CN(Cc2cc[nH]n2)C2CC2)c1 154299651 VWECHHZWEVHYHX-UHFFFAOYSA-N 272.308 2.483 5 50 CEBA COC(=O)c1cc([N+](=O)[O-])c2nc3ccccn3c2c1 1060143 AFIPIJRKFMKDIL-UHFFFAOYSA-N 271.232 2.182 5 50 CEBA Cc1cccc(C)c1NC(=O)Cn1c([N+](=O)[O-])cnc1C 89766 LSBUJCZMSQNGNA-UHFFFAOYSA-N 288.307 2.355 5 50 CEBA O=[N+]([O-])c1cccc(CN2CCN(c3ccccn3)CC2)c1 4977946 CBNDGPBOIMUAHN-UHFFFAOYSA-N 298.346 2.312 5 50 CEBA O=C(OCc1cccc([N+](=O)[O-])c1)c1ccncc1 466853 BJYCUXXRSMQYKG-UHFFFAOYSA-N 258.233 2.347 5 50 CEBA CC(=O)c1cc(N2CCC(C(=O)O)CC2)ccc1[N+](=O)[O-] 4052839 YAVQOGJHEAXYIE-UHFFFAOYSA-N 292.291 2.098 5 50 CEBA COc1cc2c(cc1OC)[C@H](C)[N@+](C)(C[C@H](C)O)CC2 252441047 CDGPCRFXVCWTDY-PRXAMGSTSA-N 280.388 2.148 5 50 CEBA biogenic O=[N+]([O-])c1cccnc1N[C@H]1CCN2CCCC[C@@H]12 222685227 CNXZWCQTRAXEIF-QWRGUYRKSA-N 262.313 2.029 5 50 CEBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1)c1ccco1 3904000 OPKKFEIWGOAVRV-UHFFFAOYSA-N 291.288 2.315 5 50 CEBA CCCN(CCC)S(=O)(=O)c1cccc([N+](=O)[O-])c1 4420519 VDXRCDGJYBNCSP-UHFFFAOYSA-N 286.353 2.406 5 50 CEBA C[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)C[C@H](C2CC2)O1 408521037 GBFFIWCBVMDXBT-QPUJVOFHSA-N 281.287 2.133 5 50 CEBA C[C@@H]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1C 221792850 VCKWMKACUHPTIA-JHJVBQTASA-N 294.351 2.065 5 50 CEBA COc1cc(NCC2([S@](C)=O)CCC2)ccc1[N+](=O)[O-] 280715922 IITCESLSLQXECO-FQEVSTJZSA-N 298.364 2.317 5 50 CEBA O=C(Nc1nccs1)c1ccc(F)cc1[N+](=O)[O-] 5016854 YKWPOOORTGNGQZ-UHFFFAOYSA-N 267.241 2.443 5 50 CEBA O=c1oc2ccccc2c2nc(N3CCCC3)ncc12 196047134 KWPPLCINFGIHFW-UHFFFAOYSA-N 267.288 2.336 5 50 CEBA C[C@H]1CN(CCCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 16488985 OUVPJANJTOYHRA-BETUJISGSA-N 294.351 2.473 5 50 CEBA Nc1nnc(Sc2ccc([N+](=O)[O-])cc2)s1 17220000 OPPQCJMYUXRMPV-UHFFFAOYSA-N 254.296 2.180 5 50 CEBA O=C(Oc1cccccc1=O)c1ccc([N+](=O)[O-])cc1 245198 FYMMOYJRZNRRAT-UHFFFAOYSA-N 271.228 2.174 5 50 CEBA CC1=CC[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]2C1 18122917 XSFLPRLCSDPYRO-CHWSQXEVSA-N 286.287 2.441 5 50 CEBA O=C(COC(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1 312937 MZVPBUPUBDAXNL-UHFFFAOYSA-N 275.216 2.228 5 50 CEBA O=c1cc(C(F)(F)F)c2cc([N+](=O)[O-])ccc2[nH]1 35063995 OEJWOBFABPUFPK-UHFFFAOYSA-N 258.155 2.455 5 50 CEBA CN(C)Cc1ccc(Br)c([N+](=O)[O-])c1 95217836 ZIYYEEOESKIGRR-UHFFFAOYSA-N 259.103 2.419 5 50 CEBA CCOc1cc(NC(=O)C(F)F)ccc1[N+](=O)[O-] 585124958 BESICQNOGKRBSI-UHFFFAOYSA-N 260.196 2.197 5 50 CEBA C[N+](C)(C)CCO[P@](=O)(O)Oc1c[nH]c2ccccc12 15205339 BUOOPGZGLXBVCI-UHFFFAOYSA-O 299.287 2.370 5 50 CEBA CN(c1ccc([N+](=O)[O-])c(N)n1)C1CCCCC1 167780244 XHCFZJWAFSOEJN-UHFFFAOYSA-N 250.302 2.341 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2cccc(Br)c2)N1 115967 FZHWJJRTEIUGMD-KOLCDFICSA-N 299.124 2.046 5 50 CEBA C[C@@H](O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4035900 LXEWZOWSTQCFQZ-ZCFIWIBFSA-N 264.203 2.406 5 50 CEBA Nc1c(Br)cnc2ccc([N+](=O)[O-])cc12 39172698 ZDANFBPFHPEARL-UHFFFAOYSA-N 268.070 2.488 5 50 CEBA CO[C@H](CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(C)(C)C 164842233 GDCFEECHUGKWKK-GFCCVEGCSA-N 296.323 2.091 5 50 CEBA Cc1ccnc(N[C@@H](C)c2cnccn2)c1[N+](=O)[O-] 585092040 BZLNVKONFWPPER-VIFPVBQESA-N 259.269 2.261 5 50 CEBA O=C1c2ccccc2C(=O)N1OCc1ccc([N+](=O)[O-])cc1 169989 KICBTWPSVKJQLP-UHFFFAOYSA-N 298.254 2.323 5 50 CEBA Cc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] 5017640 QAJAOCBFBYINDJ-UHFFFAOYSA-N 298.364 2.468 5 50 CEBA CCOC(=O)c1ncoc1-c1ccc([N+](=O)[O-])cc1 2577846 WFXGNVYQHVQFKU-UHFFFAOYSA-N 262.221 2.427 5 50 CEBA in-vitro COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccncc1 3897758 IKFOIIDGKBESHH-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA C[C@@H](O)CNC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 253421345 KWHWOZWOWABYNR-SECBINFHSA-N 295.339 2.395 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[C@@H](C)O 155727754 ZKTHFXFTMDTZRU-VXGBXAGGSA-N 292.335 2.279 5 50 CEBA CC(=O)Nc1ccc([N+](=O)[O-])cc1OC(F)(F)F 261506951 CVMBVWXQGBQHQL-UHFFFAOYSA-N 264.159 2.452 5 50 CEBA CC(C)c1[nH]ncc1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1 193926810 XNCNFRNTXOGJAI-UHFFFAOYSA-N 290.279 2.399 5 50 CEBA CC[C@H](C)NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 103444 SFNOVDGSBOWYQT-QMMMGPOBSA-N 252.270 2.132 5 50 CEBA CC(C)C(=O)NCCNc1ccc([N+](=O)[O-])cc1Cl 4506974 OIOSXLPITCLDQF-UHFFFAOYSA-N 285.731 2.432 5 50 CEBA COc1cc(NC2CN(C(C)C)C2)c([N+](=O)[O-])cc1OC 170603341 LVWJSVMYOXHORC-UHFFFAOYSA-N 295.339 2.117 5 50 CEBA Nc1ccc(CNc2ncc(Cl)cc2[N+](=O)[O-])cn1 170610798 PRDNHWFKHZQJOI-UHFFFAOYSA-N 279.687 2.233 5 50 CEBA C[C@@H]1CCCCN1c1ncnc(Cl)c1[N+](=O)[O-] 5073582 FDZIHACRTHIXBA-SSDOTTSWSA-N 256.693 2.417 5 50 CEBA CC[C@@H](CSC)Nc1cc(N)c([N+](=O)[O-])cn1 1330636790 DKJYZDZLCDDBNB-ZETCQYMHSA-N 256.331 2.126 5 50 CEBA O=C(Nc1ccc(O)c([N+](=O)[O-])c1)[C@H]1C[C@H]1c1cccnc1 170599966 NIJCUOWZCXJWNH-RYUDHWBXSA-N 299.286 2.438 5 50 CEBA O=c1ccc([N+](=O)[O-])cn1Cc1ccc(C(F)(F)F)o1 1857782868 RAIQWOKRVCEBJP-UHFFFAOYSA-N 288.181 2.417 5 50 CEBA O=[N+]([O-])c1cccc(CN2CCCC[C@H]2CCO)c1 4948704 IHTYDVBLKIUXOX-ZDUSSCGKSA-N 264.325 2.332 5 50 CEBA O=C(O)c1c(F)cc(Br)cc1[N+](=O)[O-] 261507876 NDJPAWIBZAMBIT-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA Cc1ccc(NC[C@@H]2CC(=O)N(C3CC3)C2)c([N+](=O)[O-])c1 272550569 TYCGWTHDECAOBY-NSHDSACASA-N 289.335 2.326 5 50 CEBA COC(=O)c1cc(Br)cc([N+](=O)[O-])c1F 35333522 ODDWYOBMSSXDDU-UHFFFAOYSA-N 278.033 2.283 5 50 CEBA in-vitro O=C(O)c1ccc(COc2ccc([N+](=O)[O-])cc2)o1 374055 QBTFAJGZQGYZTH-UHFFFAOYSA-N 263.205 2.465 5 50 CEBA O=C(OCC1CC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1638514 KUHLYUCDGNMGTP-UHFFFAOYSA-N 266.209 2.070 5 50 CEBA CC(C)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 4170518 UOWJZUOFTGCKEW-UHFFFAOYSA-N 263.341 2.121 5 50 CEBA O=[N+]([O-])c1cnc(Cl)c(I)c1 38295442 KUMMEUQAQSZVOD-UHFFFAOYSA-N 284.440 2.248 5 50 CEBA in-vitro Cc1cc(C)n(C(=O)c2ccc(C)c([N+](=O)[O-])c2)n1 475458 PBDJJWHQHOUERV-UHFFFAOYSA-N 259.265 2.405 5 50 CEBA COC(=O)c1ccccc1Cn1nc(C)c([N+](=O)[O-])c1C 2536972 RINMAGDRXPTEJV-UHFFFAOYSA-N 289.291 2.243 5 50 CEBA CCOC(=O)CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2684947 BJDFTBHUSCRIHE-UHFFFAOYSA-N 286.265 2.158 5 50 CEBA Cc1ccnc(N(C)Cc2ccns2)c1[N+](=O)[O-] 585092788 NVWHQFGBTRDFAK-UHFFFAOYSA-N 264.310 2.391 5 50 CEBA O=[N+]([O-])c1ccc(NS(=O)(=O)c2ccccc2)cc1 3897467 SWSJPCDGJYPPCS-UHFFFAOYSA-N 278.289 2.396 5 50 CEBA CC1=C[C@H]2C[C@H]1[C@@H]1C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]12 216083071 YPYRWGPJAJGEOF-VZLIPTOUSA-N 298.298 2.296 5 50 CEBA Cc1cc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)sn1 170599956 DYNXYLMNFYHNNX-UHFFFAOYSA-N 279.277 2.318 5 50 CEBA COC(=O)CCC(=O)Oc1ccc(Cl)cc1[N+](=O)[O-] 271166 OHGITNNOGUPMMD-UHFFFAOYSA-N 287.655 2.107 5 50 CEBA O=C1CCCc2c1nc(-c1ccc([N+](=O)[O-])cc1)n2O 494038 ZBXNVWXVGBCAOX-UHFFFAOYSA-N 273.248 2.215 5 50 CEBA Cc1ccc([N+](=O)[O-])c(OCCN2C[C@H](C)O[C@@H](C)C2)c1 20652746 GSXTXISIEHKLME-STQMWFEESA-N 294.351 2.391 5 50 CEBA Cc1cc(NC(=O)N[C@H](CO)C(C)(C)C)ccc1[N+](=O)[O-] 153837980 RWBVRYFBPPBQJU-GFCCVEGCSA-N 295.339 2.432 5 50 CEBA O=C(O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 3884579 YVODCTHEVCBRCV-UHFFFAOYSA-N 250.254 2.283 5 50 CEBA in-vitro CCOC(=O)/C=C/c1cc(OC)c(OC)cc1[N+](=O)[O-] 196144174 RUMVOJBZQRSJMS-AATRIKPKSA-N 281.264 2.188 5 50 CEBA C[C@@H]1C=CC[C@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]12 239173990 PBLZWGAYCWXFBV-WQAKAFBOSA-N 286.287 2.296 5 50 CEBA Cc1cccc2c1CC(C)(C)[N+]1(CCS(=O)(=O)CC1)C2 1615610579 LJFDMIHIWPMJRD-UHFFFAOYSA-N 294.440 2.075 5 50 CEBA O=C1NC(=O)c2cc(Oc3ccc([N+](=O)[O-])cc3)ccc21 432007 SIYSZMYKSGLGCS-UHFFFAOYSA-N 284.227 2.271 5 50 CEBA O=[N+]([O-])c1ccc(Cl)c(CN2CCC(O)CC2)c1 239072 LBMLEUNMIUPYDG-UHFFFAOYSA-N 270.716 2.205 5 50 CEBA O=C(Nc1cccc2nonc12)c1cccc([N+](=O)[O-])c1 1432103 XLQJZQIZXRHNKG-UHFFFAOYSA-N 284.231 2.383 5 50 CEBA CCC(CC)NC(=O)Cc1ccccc1[N+](=O)[O-] 456888 JGYCENHXKFGXSK-UHFFFAOYSA-N 250.298 2.442 5 50 CEBA CCC1=NSC2=NCC(c3ccc([N+](=O)[O-])cc3)=NN12 4531403 ORBYDVOMAZNFAW-UHFFFAOYSA-N 289.320 2.441 5 50 CEBA CCC(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4998704 SWOCEUKMFUIXDM-UHFFFAOYSA-N 297.742 2.307 5 50 CEBA Cc1ccc([N+](=O)[O-])c(N(C)Cc2cccnc2)n1 119814864 FWESJFAYPZLLRU-UHFFFAOYSA-N 258.281 2.330 5 50 CEBA CC(C)(C)C[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 252677911 AYMNEUZOXABTIE-HBNTYKKESA-N 254.330 2.079 5 50 CEBA CC1=C[C@H]2C[C@H]1[C@@H]1C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]12 239254665 YPYRWGPJAJGEOF-VKKKGTNTSA-N 298.298 2.296 5 50 CEBA Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnns1 170605806 FXHFVJRQKLMVEX-UHFFFAOYSA-N 264.266 2.007 5 50 CEBA O=[N+]([O-])c1ccc(N2CCOCC2)cc1N1CCCC1 4182537 OGAXLWFQZXLXDZ-UHFFFAOYSA-N 277.324 2.032 5 50 CEBA CC[C@H](OC(=O)c1ccc([N+](=O)[O-])c(C)c1)C(=O)OC 120558300 AVDUUYBSMJTCJE-NSHDSACASA-N 281.264 2.012 5 50 CEBA CCN(CC)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] 96027773 CGAMUUVPRXOPKY-UHFFFAOYSA-N 268.313 2.454 5 50 CEBA COC(=O)Cn1cc(/C=C/[N+](=O)[O-])c2ccccc21 450002 QLWQCYGEGSGDBF-VOTSOKGWSA-N 260.249 2.062 5 50 CEBA N[C@@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5127886 JXBSDLZLJPIEJN-NXEZZACHSA-N 280.284 2.185 5 50 CEBA CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 3879146 UFFIYCVVTWWGGH-UHFFFAOYSA-N 255.705 2.000 5 50 CEBA O=[N+]([O-])c1cccnc1N1CCCC[C@@H]1c1cc[nH]n1 240707791 HQOZWNVRRDNHGI-LLVKDONJSA-N 273.296 2.445 5 50 CEBA Cc1nc(N2CC[C@H](c3ncccn3)C2)ccc1[N+](=O)[O-] 952993418 NFSXDJPOBMXDOX-NSHDSACASA-N 285.307 2.082 5 50 CEBA CCc1cn(Cc2cc([N+](=O)[O-])cc3c2OCOC3)cn1 952883985 QHXGRACQVFFEPN-UHFFFAOYSA-N 289.291 2.269 5 50 CEBA COc1ccc(-c2nc(N)cs2)cc1[N+](=O)[O-] 1614839689 JRMVKDJEUGRVCH-UHFFFAOYSA-N 251.267 2.309 5 50 CEBA CC(C)Oc1cc(N2CCC(O)CC2)ccc1[N+](=O)[O-] 95495844 UIZZFBJQDDFPIA-UHFFFAOYSA-N 280.324 2.343 5 50 CEBA CCOC(=O)C(=Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC 15223817 KTTWLLFTDRIQEQ-UHFFFAOYSA-N 293.275 2.104 5 50 CEBA in-vitro Nc1ccc([N+](=O)[O-])c(N[C@H]2c3ccccc3C[C@@H]2O)c1 193386041 LMNHQNQJPZWYFW-GJZGRUSLSA-N 285.303 2.247 5 50 CEBA O=C(Nc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCCOC1 1615553020 UDUJUJZMXMFBJQ-ZETCQYMHSA-N 286.234 2.238 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccccc1O 1505122 KMQPGJZJEAYWME-UHFFFAOYSA-N 294.288 2.101 5 50 CEBA Cc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1[N+](=O)[O-] 447643 PLQYZHBUTIBNJH-UHFFFAOYSA-N 299.286 2.254 5 50 CEBA Cn1c(=O)c([N+](=O)[O-])c(N2CCCCC2)c2ccccc21 3958340 JUSSVVKDDAELSY-UHFFFAOYSA-N 287.319 2.437 5 50 CEBA Cc1cc(C(=O)N2CCC[C@@H]([C@@H](C)N)C2)cc([N+](=O)[O-])c1 135237270 SXHCEVOZEOEIIK-VXGBXAGGSA-N 291.351 2.103 5 50 CEBA CN=[S@](C)(=O)CCNc1ccc(Cl)cc1[N+](=O)[O-] 408518776 ZGZSULWCRQNGQN-GOSISDBHSA-N 291.760 2.388 5 50 CEBA O=C(O)c1cc(OC(F)(F)F)ccc1[N+](=O)[O-] 16158718 GQEIKAXUKWLVPL-UHFFFAOYSA-N 251.116 2.192 5 50 CEBA in-vitro CC(C)OCCCNc1ncc(F)cc1[N+](=O)[O-] 401177134 YFCKJUZCUMQVSX-UHFFFAOYSA-N 257.265 2.356 5 50 CEBA Cn1cc(CNc2cccc(F)c2)c([N+](=O)[O-])n1 1875357924 BRYYQGGQHFLRNM-UHFFFAOYSA-N 250.233 2.080 5 50 CEBA O=C(O)CCSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2150326 WRABUSWKVRCOCO-UHFFFAOYSA-N 272.238 2.070 5 50 CEBA CCc1ncsc1NC(=O)c1cc([N+](=O)[O-])ccc1N 225543806 BJGIRWIVHBIICI-UHFFFAOYSA-N 292.320 2.448 5 50 CEBA CCCCCn1cc([N+](=O)[O-])s/c1=N\C(=O)NCC 71771610 LOBLBGZUVADZMY-QBFSEMIESA-N 286.357 2.278 5 50 CEBA O=[N+]([O-])c1cccc(I)c1F 238565157 WSBBGGJMXFKGAF-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA CC(=O)c1ccc(N2CCc3nc[nH]c3C2)c([N+](=O)[O-])c1 408518698 VOFWZESULULSDB-UHFFFAOYSA-N 286.291 2.083 5 50 CEBA C/C=C(C(=C/CC)\OCCNC[C@H]1CCCO1)/[N+](=O)[O-] 1857667086 VMNRHDMQHYDVPJ-VLDJVBPYSA-N 284.356 2.246 5 50 CEBA CC(C)Oc1ccccc1[C@@H]1NC(=O)CC[C@@H]1[N+](=O)[O-] 90372 GZKUGDIHWJPWNL-FZMZJTMJSA-N 278.308 2.070 5 50 CEBA O=C(O)[C@@H]1CC=CC[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 265988 RQDJQZJFPQXPPH-VXGBXAGGSA-N 290.275 2.200 5 50 CEBA O=[N+]([O-])c1cnc(Nc2cnn(CC3CC3)c2)s1 192472102 VKCCKZLAPMRKNB-UHFFFAOYSA-N 265.298 2.401 5 50 CEBA O=[N+]([O-])c1ccc(F)c(CSc2nnnn2C2CC2)c1 1615546654 AZGAYLPDFFRPKM-UHFFFAOYSA-N 295.299 2.348 5 50 CEBA Cc1cc(C(=O)NCc2cccnc2)ccc1[N+](=O)[O-] 51871 GZOHMXVSEIUWAV-UHFFFAOYSA-N 271.276 2.228 5 50 CEBA CCn1ncc(Cn2cc(Cl)c([N+](=O)[O-])n2)c1C 2741024 JTCSTFYECFFGRX-UHFFFAOYSA-N 269.692 2.018 5 50 CEBA O=[N+]([O-])c1ccc(CS(=O)(=O)c2nccs2)cc1 195028672 UFXNDAATKBPXIY-UHFFFAOYSA-N 284.318 2.025 5 50 CEBA COCCCNCCCOc1ccc(C)cc1[N+](=O)[O-] 3461311 XQJOXYDROPOGAO-UHFFFAOYSA-N 282.340 2.298 5 50 CEBA O=[N+]([O-])c1cc(CN2CCCC2)c2cccnc2c1O 20119324 ZRJDLIPVEZBXHD-UHFFFAOYSA-N 273.292 2.444 5 50 CEBA O=C1C(=O)N(Cc2cccc([N+](=O)[O-])c2)c2ccccc21 2054672 VTCUAJNKKBKMFZ-UHFFFAOYSA-N 282.255 2.324 5 50 CEBA CSCCCN(C)c1ncc([N+](=O)[O-])cc1C 241588212 PAWBLRVZOWPHOR-UHFFFAOYSA-N 255.343 2.488 5 50 CEBA NC(=O)N1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 301426389 HPBIDCODCCEPMW-QMMMGPOBSA-N 298.730 2.203 5 50 CEBA COc1cc(NCC2([S@@](C)=O)CCC2)ccc1[N+](=O)[O-] 280715923 IITCESLSLQXECO-HXUWFJFHSA-N 298.364 2.317 5 50 CEBA CC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 4899507 SLJKQHDBYBGOMH-ZDUSSCGKSA-N 293.323 2.084 5 50 CEBA in-vitro O=C1[C@H]2CC=CC[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 100399476 NTINCPQSZRXXQY-TXEJJXNPSA-N 272.260 2.050 5 50 CEBA CC(C)(C)OC(=O)CNCCc1cccc([N+](=O)[O-])c1 44126841 IFDCUSLUDNJZQY-UHFFFAOYSA-N 280.324 2.069 5 50 CEBA Cn1c(=O)c(-c2cc([N+](=O)[O-])ccc2N)nc2ccccc21 3880345 CBNODDLIJOMTFC-UHFFFAOYSA-N 296.286 2.091 5 50 CEBA O=[N+]([O-])c1cc([N+](=O)[O-])c2nc3ncccc3c(O)c2c1 3832854 SKAYCPVRSTYRTE-UHFFFAOYSA-N 286.203 2.305 5 50 CEBA CC[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 3156785 QLGQUWQXUVQKCR-ZETCQYMHSA-N 281.268 2.340 5 50 CEBA biogenic CC(=O)Nc1cccc(Br)c1[N+](=O)[O-] 38537508 SSLHIABEJDXTOZ-UHFFFAOYSA-N 259.059 2.316 5 50 CEBA O=C(Nc1nc2ccc([N+](=O)[O-])cc2s1)[C@@H]1CCCO1 375982 JPSIHHYQIJOCMN-VIFPVBQESA-N 293.304 2.322 5 50 CEBA Cc1cc(I)c(O)c([N+](=O)[O-])c1 37102953 ZGSKNXKQYFZYAW-UHFFFAOYSA-N 279.033 2.213 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2ccccc2Br)N1 90368 AWZHFUMNBBNKNS-MWLCHTKSSA-N 299.124 2.046 5 50 CEBA CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)C[C@@H]1C 4949554 VOYRQZQPJJBYLD-JTQLQIEISA-N 295.314 2.181 5 50 CEBA Cc1ccc(-n2c(C[N+](=O)[O-])nnc2C(F)(F)F)cc1 3015724 UMWNSKUNMDOWCF-UHFFFAOYSA-N 286.213 2.371 5 50 CEBA COc1cc(Br)cc(OC)c1[N+](=O)[O-] 98213379 JYBBJCVTCJWZRU-UHFFFAOYSA-N 262.059 2.375 5 50 CEBA C[Si](C)(C)[C@@]12[C@H]3[C@@H]4[C@@H]5C[C@H]3[C@@]36O[C@@]53[C@H](C[C@@H]61)[C@@]42[N+](=O)[O-] 257356450 ICEFMYGKFMZPDE-STXJICNLSA-N 289.407 2.147 5 50 CEBA C[C@@H](CN(C)c1cnc([N+](=O)[O-])c(O)c1)c1nccs1 952993554 INSGQLRTFKNQKR-QMMMGPOBSA-N 294.336 2.392 5 50 CEBA CC(=O)Nc1cc([N+](=O)[O-])ccc1N1C[C@@H](C)O[C@H](C)C1 1776111366 QTTFJVXWGKLNSS-NXEZZACHSA-N 293.323 2.167 5 50 CEBA O=[N+]([O-])c1cc(F)ccc1NC(=S)NC[C@H]1CCCO1 5041983 WEDULJWLPLNTEX-SECBINFHSA-N 299.327 2.199 5 50 CEBA O=C1c2ccccc2C(=O)N1CNc1cccc([N+](=O)[O-])c1 3151493 GIGNYFQSNSNEPU-UHFFFAOYSA-N 297.270 2.260 5 50 CEBA CC1(C)C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)CCO1 148580953 TZURVZDIPGGLKL-SECBINFHSA-N 296.298 2.421 5 50 CEBA CNc1c(OC)cc(Br)cc1[N+](=O)[O-] 306564117 DOBMDBUZZCNJAY-UHFFFAOYSA-N 261.075 2.408 5 50 CEBA COc1cc(N2CCC(=O)C(C)(C)C2)ccc1[N+](=O)[O-] 114003384 LRTMIVUYUTYCFV-UHFFFAOYSA-N 278.308 2.409 5 50 CEBA O=C(O)Cc1c(F)cc(Br)cc1[N+](=O)[O-] 96321134 OUWVGTRCXLLTOT-UHFFFAOYSA-N 278.033 2.124 5 50 CEBA Cc1nonc1OCCCNc1ccc([N+](=O)[O-])cc1 5361163 OVOBKCDMRLEJJO-UHFFFAOYSA-N 278.268 2.167 5 50 CEBA CCO[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)[C@@]12CCCO2 273471048 IHPCQMCUNCQYTO-SCRDCRAPSA-N 293.323 2.128 5 50 CEBA CC1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 5064344 HVMRHDODRSJLEQ-UHFFFAOYSA-N 277.324 2.265 5 50 CEBA Cc1c([N+](=O)[O-])cnn1CCC(=O)NC1CCCCCC1 2805140 XPSJYOLYNMLREK-UHFFFAOYSA-N 294.355 2.329 5 50 CEBA CC(C)(C)OCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1 166181094 AAARQGAEVRSQGF-UHFFFAOYSA-N 268.269 2.054 5 50 CEBA Cc1ccc(CN[C@@H](C)C[C@H](C)O)cc1[N+](=O)[O-] 228068504 GCLFEVMDWZLKTQ-QWRGUYRKSA-N 252.314 2.152 5 50 CEBA COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cn2)cc1 4113850 CVZQKOGRWDCNPZ-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA CC(C)(Oc1ccc([N+](=O)[O-])cc1Cl)C(=O)O 2557829 ZLDJFKWZIPCOEU-UHFFFAOYSA-N 259.645 2.490 5 50 CEBA C[C@H](Nc1ncnc(N)c1[N+](=O)[O-])c1ccccc1 3912529 CDGZNSBLGPGMDZ-QMMMGPOBSA-N 259.269 2.140 5 50 CEBA CCN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)N=C1S 4845735 YUGBKMVHFKJVTQ-YFHOEESVSA-N 277.305 2.084 5 50 CEBA O=C1C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc21 2746346 FGSNEAMVFHNNKI-UHFFFAOYSA-N 282.255 2.324 5 50 CEBA CN(C)C(=O)c1cccc([N+](=O)[O-])c1Br 134209755 UDXSVVLOIZWZDY-UHFFFAOYSA-N 273.086 2.059 5 50 CEBA COc1cccc([N+](=O)[O-])c1NCCNC(=O)C(C)(C)C 408516857 WVUGMEUUFJYWPH-UHFFFAOYSA-N 295.339 2.178 5 50 CEBA C[C@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CCN1 3998706 NECMVUPTUANASG-QMMMGPOBSA-N 255.705 2.046 5 50 CEBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(F)cc1F 1428843 VEEIDOCGXJXVEU-UHFFFAOYSA-N 296.233 2.017 5 50 CEBA Cc1c([N+](=O)[O-])ncn1CCOc1ccc([N+](=O)[O-])cc1 1775993459 RGXDRUDRFPLTII-UHFFFAOYSA-N 292.251 2.087 5 50 CEBA O=[N+]([O-])c1ccc(N[C@@H](CO)Cc2nccs2)c(F)c1 1615587883 UJDUWQKKIHRSNB-MRVPVSSYSA-N 297.311 2.206 5 50 CEBA O=[N+]([O-])c1ccc([S@](=O)Nc2ccc(O)cc2)cc1 5731136 BROPCYYYAITPIA-LJQANCHMSA-N 278.289 2.435 5 50 CEBA Cc1ccnc(N[C@@H]2C[C@H](C)N(C3CC3)C2)c1[N+](=O)[O-] 133551744 FGDPXEMIHPAZRY-WDEREUQCSA-N 276.340 2.335 5 50 CEBA Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1[N+](=O)[O-] 4611150 WLOBIKJUNBYPDB-LLVKDONJSA-N 298.364 2.466 5 50 CEBA Cc1ccc([N+](=O)[O-])cc1N1C(=O)CN(CC(C)C)C1=O 328594759 BDBNVVXDXYOAJH-UHFFFAOYSA-N 291.307 2.328 5 50 CEBA O=[N+]([O-])c1cccc(Cl)c1CN1CCOCC1 163268956 CLXZATQMZBFKOG-UHFFFAOYSA-N 256.689 2.080 5 50 CEBA O=CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 431926 YJBHQKZGDIWRLZ-CQSZACIVSA-N 256.261 2.430 5 50 CEBA COCCOC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2156366 NTOIHGPTKOMSQU-UHFFFAOYSA-N 274.660 2.443 5 50 CEBA CCCCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 3159370 TVJYDRAYQRPCIP-UHFFFAOYSA-N 272.326 2.063 5 50 CEBA CCCC(=O)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 4819115 PSCUJLODAAMGBA-UHFFFAOYSA-N 295.314 2.183 5 50 CEBA Cn1ncc2cc3oc4cc(O)cc(O)c4c3nc21 409415322 ARVNVNYSDXCZQY-UHFFFAOYSA-N 255.233 2.279 5 50 CEBA Cc1cc([N+](=O)[O-])cnc1N1C[C@@]2(C)CN(C)C[C@]2(C)C1 585132660 JXPMZIAGKQEEKN-HUUCEWRRSA-N 290.367 2.076 5 50 CEBA C[C@@H]1C(=O)C(C)(C)C(=O)O[C@H]1c1ccc([N+](=O)[O-])cc1 182549 LBIIJNHUKQSKIJ-GZMMTYOYSA-N 277.276 2.424 5 50 CEBA C[C@@]12C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]1[C@H]1C=C[C@H]2C1 239175756 QPHSVVNVYBKYKQ-BEAPKZTASA-N 298.298 2.296 5 50 CEBA CCC(=O)c1ccc(N2C[C@@H](C)[C@H](CN)C2)c([N+](=O)[O-])c1 864586805 XUIQKUJUKXWJKH-ZYHUDNBSSA-N 291.351 2.219 5 50 CEBA CCOc1cc(NC(=O)[C@H]2CCCO2)ccc1[N+](=O)[O-] 585124970 BNMULKFPHKNVHY-LLVKDONJSA-N 280.280 2.111 5 50 CEBA Cc1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1C 371091 BBJWPTWJMYBWKG-UHFFFAOYSA-N 274.280 2.047 5 50 CEBA O=[N+]([O-])c1cc(F)c(Br)c([N+](=O)[O-])c1 113819802 HRGNVARTBYIBSA-UHFFFAOYSA-N 264.994 2.405 5 50 CEBA O=C(O)COc1cc([N+](=O)[O-])c(Cl)cc1Cl 1606602 MNXWREGNAUJMIX-UHFFFAOYSA-N 266.036 2.365 5 50 CEBA O=C(Nn1cc2cc([N+](=O)[O-])ccc2n1)c1ccccc1 22130585 FUJUSPNSAFUQJJ-UHFFFAOYSA-N 282.259 2.328 5 50 CEBA O=C(O)c1cc(F)cc(Br)c1[N+](=O)[O-] 169748248 FSQLAPZDEQXCLJ-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA Cc1cc(Br)c2ncc([N+](=O)[O-])n2c1 38537210 HSSOUVZEUPLNKU-UHFFFAOYSA-N 256.059 2.313 5 50 CEBA in-vitro O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCSC1 279607347 QHRZKIIZKXGZLU-LLVKDONJSA-N 280.349 2.007 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2ccccc2Br)N1 90365 AWZHFUMNBBNKNS-KOLCDFICSA-N 299.124 2.046 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1cccs1 475821 RSNGUGHWITUZDT-UHFFFAOYSA-N 298.345 2.135 5 50 CEBA CN1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 4549331 GYZYCENBDCHKGE-UHFFFAOYSA-N 255.705 2.000 5 50 CEBA CCOC(=O)Cc1ccc(Br)cc1[N+](=O)[O-] 71609737 VZLHDZQLBGMIGO-UHFFFAOYSA-N 288.097 2.463 5 50 CEBA O=[N+]([O-])c1cc(Cl)c(Cl)cc1NCCO 4578759 MHNVDTOXGNXJPT-UHFFFAOYSA-N 251.069 2.306 5 50 CEBA CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)[C@]12CCCO2 273471049 IHPCQMCUNCQYTO-YRGRVCCFSA-N 293.323 2.128 5 50 CEBA COc1ccc(NC(=O)c2ccco2)c([N+](=O)[O-])c1 3958665 YVSLGWKHGUBBCV-UHFFFAOYSA-N 262.221 2.449 5 50 CEBA Cc1ccc(Sc2nc([N+](=O)[O-])nn2C)cc1 465379 WPIDHHROANJLHF-UHFFFAOYSA-N 250.283 2.183 5 50 CEBA CN(C)c1c([N+](=O)[O-])cc([N+](=O)[O-])c2cccnc12 3880734 AEEHUYPODDIQHA-UHFFFAOYSA-N 262.225 2.117 5 50 CEBA CC(=O)c1ccc(NC[C@@H]2CC(C)=NO2)c([N+](=O)[O-])c1 408523757 VDCOADCVQIVTPR-NSHDSACASA-N 277.280 2.374 5 50 CEBA C[C@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 13124926 PTSMTPGJTINRMS-PKRZQGHMSA-N 290.319 2.244 5 50 CEBA COCCNCCCCOc1ccc(C)cc1[N+](=O)[O-] 3003416 QDJFYJQZUFTKPZ-UHFFFAOYSA-N 282.340 2.298 5 50 CEBA CC1(C)C[C@H](CC(=O)Nc2ccccc2[N+](=O)[O-])C(=O)O1 4724406 VKGPSODTCVSJHR-VIFPVBQESA-N 292.291 2.265 5 50 CEBA CCNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 37247259 CBAINLIMJMMFGC-UHFFFAOYSA-N 273.086 2.107 5 50 CEBA in-vitro C[C@@H]1CN(CCCOc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 20167822 RBZBAAXMDDRYAU-CHWSQXEVSA-N 294.351 2.473 5 50 CEBA COc1ccc([N+](=O)[O-])c(I)c1 2379303 NLTAHTYBZZSCIT-UHFFFAOYSA-N 279.033 2.208 5 50 CEBA in-vitro O=[N+]([O-])c1ccc(N2CCN(c3ccccc3)CC2)nc1 19640759 TWDYOWBTLDZFJA-UHFFFAOYSA-N 284.319 2.316 5 50 CEBA Cc1ccc(C(=O)NCc2cccnc2)cc1[N+](=O)[O-] 183255 OQJIHDLAGNFTAA-UHFFFAOYSA-N 271.276 2.228 5 50 CEBA CC[C@H](OC(C)=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 4537324 NVRQCSAIOZHSQA-NSHDSACASA-N 281.264 2.380 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H]3OCCC[C@@H]23)c1 249204407 AWFYVODLDALFMD-OPQQBVKSSA-N 263.297 2.156 5 50 CEBA CC1CCN(CC(=O)Nc2cccc([N+](=O)[O-])c2)CC1 5065233 RKXZGFZDGUDVFO-UHFFFAOYSA-N 277.324 2.265 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2ccc(Br)cc2)N1 221456 VYMIHEBRKGBIJG-KOLCDFICSA-N 299.124 2.046 5 50 CEBA O=C(COc1ccccc1[N+](=O)[O-])NCc1ccccc1 115689 JIFPWTCRINEGFK-UHFFFAOYSA-N 286.287 2.290 5 50 CEBA Cc1nc(Oc2cc([N+](=O)[O-])ccc2C)nc(N(C)C)n1 488427480 UUKFPOFSSJAZCU-UHFFFAOYSA-N 289.295 2.255 5 50 CEBA O=[N+]([O-])c1cc([N+](=O)[O-])c(Br)cc1F 1706142 DLNYTDLCDYDPLV-UHFFFAOYSA-N 264.994 2.405 5 50 CEBA in-vitro O=C(Nc1ncccn1)c1ccc([N+](=O)[O-])cc1Cl 236288 PBBNAKFFEVLQKY-UHFFFAOYSA-N 278.655 2.291 5 50 CEBA Cc1nn(C)c(C)c1NC(=O)c1ccc([N+](=O)[O-])cc1 64707 YJIQYIJCGIHAKZ-UHFFFAOYSA-N 274.280 2.197 5 50 CEBA CCN(CC)c1cc(N2CCOCC2)c([N+](=O)[O-])cc1F 4706639 FLVBYBFNJSRJDU-UHFFFAOYSA-N 297.330 2.417 5 50 CEBA CC(=O)N1c2ccc([N+](=O)[O-])cc2N(C(C)=O)[C@@H](C)[C@@H]1C 4769762 PMTHDUKCVRFGKD-IUCAKERBSA-N 291.307 2.091 5 50 CEBA O=[N+]([O-])c1cccnc1N1CCOC[C@@H]1Cc1ccccc1 426881771 KXMXLLZRMCBDKB-AWEZNQCLSA-N 299.330 2.438 5 50 CEBA O=C(Nc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CCCO1 473368 ZNVQSDFEEBDVNZ-JTQLQIEISA-N 270.672 2.366 5 50 CEBA CCN(CC)CCNc1ccc2nsnc2c1[N+](=O)[O-] 4358960 HSGHJVTYQZAALK-UHFFFAOYSA-N 295.368 2.353 5 50 CEBA O=C(NCCCN1CCCC1)Nc1ccccc1[N+](=O)[O-] 4908708 UPIZBROYJVLFAC-UHFFFAOYSA-N 292.339 2.202 5 50 CEBA CC(C)(CNc1ccnc2c([N+](=O)[O-])cccc12)C(N)=O 230399008 SKDCRBKLFBNEHF-UHFFFAOYSA-N 288.307 2.066 5 50 CEBA O=[N+]([O-])c1cc(Br)nc(Br)c1O 675050647 NVJFMOAXTJMHCY-UHFFFAOYSA-N 297.890 2.220 5 50 CEBA CCn1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2)c(C)n1 372986 OOVGIRRUEUACRB-UHFFFAOYSA-N 288.307 2.050 5 50 CEBA CCOCCCNC(=O)c1ccc(C)c([N+](=O)[O-])c1 2805273 QBFLSIWAKYKDOZ-UHFFFAOYSA-N 266.297 2.060 5 50 CEBA O=c1oc2cc([N+](=O)[O-])ccc2n1CNC1CCCCC1 3100131 CWTXZPYNDCHULJ-UHFFFAOYSA-N 291.307 2.383 5 50 CEBA Nc1ccc(Oc2ccc(N)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 3878369 UPUDSFHDZIXLGD-UHFFFAOYSA-N 290.235 2.460 5 50 CEBA O=[N+]([O-])c1ccc(CSC(=S)N2CCOCC2)cc1 71196117 ZGEUXOYPPBYZSB-UHFFFAOYSA-N 298.389 2.445 5 50 CEBA CC(=O)Nc1cc([N+](=O)[O-])ccc1N1C[C@H](C)O[C@@H](C)C1 1776111367 QTTFJVXWGKLNSS-UWVGGRQHSA-N 293.323 2.167 5 50 CEBA Nc1nc(=O)c2cnc3c(Cl)cccc3c2s1 19702762 ICCWABLWUHWPTE-UHFFFAOYSA-N 263.709 2.440 5 50 CEBA O=c1[nH]c(O)nc(/C=C\c2ccc(Cl)cc2)c1[N+](=O)[O-] 16293368 KSXHLQMMCZBVIS-UTCJRWHESA-N 293.666 2.208 5 50 CEBA CC(=O)N1N=C(c2ccc([N+](=O)[O-])cc2)OC12CCCC2 58373 ZDXJIFSLVPNOQI-UHFFFAOYSA-N 289.291 2.405 5 50 CEBA CC(C)(C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 612331 HMURLUHOCBYFJC-UHFFFAOYSA-N 290.275 2.230 5 50 CEBA Cc1cccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1C 1009291 FEOLZYBGHFCQMG-UHFFFAOYSA-N 288.307 2.437 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1-n1cncn1 202135 KZMGWGNOCPTZDA-UHFFFAOYSA-N 258.159 2.194 5 50 CEBA CCOCC(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 2842353 TVOFWYYUTYLYQT-UHFFFAOYSA-N 281.293 2.180 5 50 CEBA Cc1n[nH]c(C)c1NC(=O)c1cccc([N+](=O)[O-])c1 105349 AXAGAJMFFWLJIW-UHFFFAOYSA-N 260.253 2.187 5 50 CEBA O=C(N[S@@](=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 4425788 YXZYHEOOUQOCJD-HXUWFJFHSA-N 290.300 2.047 5 50 CEBA CCc1n[nH]c(Sc2ccc(C=O)cc2[N+](=O)[O-])n1 4811073 GDTBLCMZOHQFHD-UHFFFAOYSA-N 278.293 2.239 5 50 CEBA CC(C)(C)N=c1[nH]nc(-c2ccc([N+](=O)[O-])cc2)o1 1875268825 XWWKYHVFRJYSRU-UHFFFAOYSA-N 262.269 2.277 5 50 CEBA O=[N+]([O-])c1cccc(CN2CC3CCC2(CO)CC3)c1 1875337865 HQZRGKOLVOKDGK-UHFFFAOYSA-N 276.336 2.332 5 50 CEBA CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1 12414057 RBTBFTRPCNLSDE-UHFFFAOYSA-N 284.408 2.499 5 50 CEBA aggregator,fda CC1(C)C[C@@H]1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1 166115468 UBXLBICXIQUIFH-MRVPVSSYSA-N 250.254 2.285 5 50 CEBA C[C@@H]1CC(=O)NN=C1c1ccc(Cl)c([N+](=O)[O-])c1 4318148 YJXLFWFRDVWRSY-ZCFIWIBFSA-N 267.672 2.108 5 50 CEBA O=C(CCn1cc(Cl)cn1)Nc1ccccc1[N+](=O)[O-] 148709797 BOVQLQPMHTVLFL-UHFFFAOYSA-N 294.698 2.474 5 50 CEBA CC(=O)c1ccc(NCCc2nncs2)c([N+](=O)[O-])c1 1615585515 IRBJHOOMEFLRGY-UHFFFAOYSA-N 292.320 2.304 5 50 CEBA CC1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 271957 KMPYGZSGASXYPW-UHFFFAOYSA-N 284.337 2.015 5 50 CEBA CC(=O)c1ccc(N2CC[C@@H](N(C)C)[C@H]2C)c([N+](=O)[O-])c1 314851717 DPRRXNHTHZAVNC-ZWNOBZJWSA-N 291.351 2.326 5 50 CEBA O=C(O)c1ccc(Cn2cc(Cl)c([N+](=O)[O-])n2)cc1 368977 NDPOIGJDZZNZNU-UHFFFAOYSA-N 281.655 2.191 5 50 CEBA O=C(COc1ccccc1[N+](=O)[O-])n1cc(Cl)cn1 997721 AULHDGHMCMFMDL-UHFFFAOYSA-N 281.655 2.164 5 50 CEBA C[C@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CCN1 4005709 GIRKMKZFBUAZMN-QMMMGPOBSA-N 255.705 2.046 5 50 CEBA O=C(C1CCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4750366 FZNAGSHUXDEFTH-UHFFFAOYSA-N 289.335 2.044 5 50 CEBA CC1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 225749869 CFUMTSSZMREJAU-UHFFFAOYSA-N 289.335 2.287 5 50 CEBA COc1ccc([N+](=O)[O-])c(N2CCCO[C@@H](C)C2)c1 266417057 RKUYAYYIJJRERU-JTQLQIEISA-N 266.297 2.219 5 50 CEBA O=[N+]([O-])c1ccc(OCCCCN2CCOCC2)cc1 19607338 SBINKGYXGYWIAC-UHFFFAOYSA-N 280.324 2.086 5 50 CEBA C[C@H](C(=O)Nc1ccc(F)cc1F)n1cc([N+](=O)[O-])cn1 1423796 MRTBKZHSRLIADM-SSDOTTSWSA-N 296.233 2.269 5 50 CEBA O=CN[C@@H]1CCCc2c1[nH]c1ccc([N+](=O)[O-])cc21 273599 RUELWXLIPDINIR-GFCCVEGCSA-N 259.265 2.200 5 50 CEBA Cc1nn(CC2(C)COC2)c2ccc([N+](=O)[O-])cc12 355443914 YMAUVKBTJIQFJM-UHFFFAOYSA-N 261.281 2.289 5 50 CEBA Cc1nc(Oc2ccc([N+](=O)[O-])c(C)c2)nc(N(C)C)n1 489473328 HMMJFUXJTBQCIS-UHFFFAOYSA-N 289.295 2.255 5 50 CEBA CCOC[C@@H](O)COc1c(C)cc(Cl)cc1[N+](=O)[O-] 241371420 MNMBSOSNGFNFFH-SNVBAGLBSA-N 289.715 2.333 5 50 CEBA O=[N+]([O-])c1cccnc1N1CCC=C(Br)C1 239619624 BFVUBXCJRCATSF-UHFFFAOYSA-N 284.113 2.479 5 50 CEBA CC1(C)C[C@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1 4093735 MBGZTKSUFLIELQ-VIFPVBQESA-N 292.291 2.265 5 50 CEBA C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)[C@@H](O)c1ccccc1)C2 100012630 WKWOJBUWWZTUQV-JJXSEGSLSA-N 290.383 2.033 5 50 CEBA in-man Cc1ccc(C(=O)CCn2cc([N+](=O)[O-])ccc2=O)cc1 129897795 REVRRYNSRHOOAU-UHFFFAOYSA-N 286.287 2.338 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2cccc(Br)c2)N1 115960 FZHWJJRTEIUGMD-ONGXEEELSA-N 299.124 2.046 5 50 CEBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CC=CC[C@H]1C(=O)O 265986 RQDJQZJFPQXPPH-NWDGAFQWSA-N 290.275 2.200 5 50 CEBA O=[N+]([O-])c1cnc(Nc2cnn(C[C@@H]3CCCO3)c2)s1 253425137 AZWABRYXQFRIDA-VIFPVBQESA-N 295.324 2.170 5 50 CEBA O=c1oc(-c2ccccc2)nn1-c1ccc([N+](=O)[O-])cc1 71772888 YHGCIUNMMOTCJO-UHFFFAOYSA-N 283.243 2.401 5 50 CEBA CCn1c(=O)cc(C)c2cc3c(C)cc(=O)n4c3c(c21)OC4 261506921 CLFGYIMAZCFMED-UHFFFAOYSA-N 296.326 2.303 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[C@H]1C 123028556 CBZXGNGUWMHPPJ-GMSGAONNSA-N 265.269 2.133 5 50 CEBA CC(C)c1ccc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 107294 KAELMYGEWHEWBH-GXTWGEPZSA-N 262.309 2.406 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2ccc(C(F)(F)F)cc2)N1 115989 LJCIZWPTTFFJTB-KOLCDFICSA-N 288.225 2.302 5 50 CEBA O=C(CCCn1cc([N+](=O)[O-])cn1)Nc1ccccc1 1423698 ILODJLHDFOKNNU-UHFFFAOYSA-N 274.280 2.210 5 50 CEBA Nc1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])s2)cc1 5933354 RAYDBWYVPFHUMR-UHFFFAOYSA-N 284.318 2.071 5 50 CEBA Cc1ccc(NC(=O)[C@H]2CCCO2)c([N+](=O)[O-])c1 4614017 VJCKWJKQOUDHAZ-LLVKDONJSA-N 250.254 2.021 5 50 CEBA CC(C)OC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 162849066 CFAPGXABELSTPG-UHFFFAOYSA-N 289.291 2.405 5 50 CEBA O=C1C(=O)N(Cc2ccccc2[N+](=O)[O-])c2ccccc21 2855453 DOYKNAFJCIFMHL-UHFFFAOYSA-N 282.255 2.324 5 50 CEBA C[C@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 20167674 PMKVSECKMYBFLA-RYUDHWBXSA-N 280.324 2.083 5 50 CEBA O=[N+]([O-])c1cc2c(cc1Br)CNCC2 95495803 MLIZUKAIRKGUIM-UHFFFAOYSA-N 257.087 2.003 5 50 CEBA CN(C(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H](CO)C(C)(C)C 170681430 PAMTZNGGOGIUJL-LBPRGKRZSA-N 295.339 2.466 5 50 CEBA Cc1ccnc(SCCn2cccn2)c1[N+](=O)[O-] 585092193 IVOLQSFXVWJRLG-UHFFFAOYSA-N 264.310 2.287 5 50 CEBA Cn1nc(Br)c2cc([N+](=O)[O-])ccc21 12336530 QWSNHRDLAUTWJP-UHFFFAOYSA-N 256.059 2.244 5 50 CEBA CC(C)Oc1ccccc1[C@H]1NC(=O)CC[C@H]1[N+](=O)[O-] 90383 GZKUGDIHWJPWNL-BXUZGUMPSA-N 278.308 2.070 5 50 CEBA CN1CCN(c2cc([N+](=O)[O-])ccc2Cl)CC1 36170 BBEHRXGLHAJECJ-UHFFFAOYSA-N 255.705 2.000 5 50 CEBA Nc1cc(Br)nc(Br)c1[N+](=O)[O-] 71254782 KIELQQMDXWZGKC-UHFFFAOYSA-N 296.906 2.097 5 50 CEBA CCN(C)C[C@@H]1CCN(c2cc(OC)ccc2[N+](=O)[O-])C1 170652507 RBHICTVFFWXDJL-LBPRGKRZSA-N 293.367 2.381 5 50 CEBA CSc1nc(-c2ccc([N+](=O)[O-])cc2)nn1C 134003 NSTULHRAEJNURH-UHFFFAOYSA-N 250.283 2.112 5 50 CEBA O=C(O[C@H]1CC[C@H]2CC[C@H]1O2)c1ccc([N+](=O)[O-])cc1 101036306 YENKBFVBBODBLU-UPJWGTAASA-N 277.276 2.462 5 50 CEBA Cc1c([N+](=O)[O-])cc(C(=O)N2CCCCC2)cc1[N+](=O)[O-] 2831440 AXNBXIMZXOHDOX-UHFFFAOYSA-N 293.279 2.438 5 50 CEBA biogenic C[Si](C)(C)[C@@]12[C@H]3[C@@H]4[C@@H]5C[C@H]3[C@]36O[C@@]53[C@H](C[C@H]16)[C@@]42[N+](=O)[O-] 257356451 ICEFMYGKFMZPDE-XAIVTDPNSA-N 289.407 2.147 5 50 CEBA C[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 18143632 XZAAEPTZJMPZTJ-YFHYCDLPSA-N 290.319 2.244 5 50 CEBA O=[N+]([O-])c1cccc(S(=O)(=O)NC2CCCCC2)c1 4369126 NEMRFPHOJNZVTN-UHFFFAOYSA-N 284.337 2.206 5 50 CEBA Cc1ccc([N+](=O)[O-])c(NCc2ccc(N)nc2)c1 170615134 MMHFWONTHXARKR-UHFFFAOYSA-N 258.281 2.493 5 50 CEBA O=[N+]([O-])c1ccsc1NCCc1nncs1 1615586381 UUJPUFDVBOJVGJ-UHFFFAOYSA-N 256.312 2.162 5 50 CEBA C[C@@H](Nc1ncnc(N)c1[N+](=O)[O-])c1ccccc1 3912530 CDGZNSBLGPGMDZ-MRVPVSSYSA-N 259.269 2.140 5 50 CEBA O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCCC1 6329415 SSHKTLSLBNQIPB-UHFFFAOYSA-N 254.673 2.484 5 50 CEBA O=C(COc1ccccc1)Nc1cc([N+](=O)[O-])ccc1O 35832778 FCXZRQZHXKOILC-UHFFFAOYSA-N 288.259 2.318 5 50 CEBA COc1ccc(Br)c(C(=O)O)c1[N+](=O)[O-] 44857573 GDQNQIOGEJXLHT-UHFFFAOYSA-N 276.042 2.064 5 50 CEBA COC1(OC)CC(Nc2nc3ccc([N+](=O)[O-])cc3[nH]2)C1 1164191057 WHGUGFILDCCCIP-UHFFFAOYSA-N 292.295 2.035 5 50 CEBA O=C(Cc1ccc([N+](=O)[O-])cc1)N=c1[nH]c2ccccc2[nH]1 13161804 GBSOZZSBCKOVJY-UHFFFAOYSA-N 296.286 2.074 5 50 CEBA C[C@H](C(=O)Nc1ccccc1F)n1cc([N+](=O)[O-])cn1 1421979 RLEPBBDBIGRKHE-MRVPVSSYSA-N 278.243 2.130 5 50 CEBA O=C1CCN(C(=O)c2csc([N+](=O)[O-])c2)C2(CCC2)C1 891835662 HLFRVSNILXWAJX-UHFFFAOYSA-N 294.332 2.384 5 50 CEBA CCOc1cc(C)nn1-c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2575847 HDSQZNREAHBRLS-UHFFFAOYSA-N 292.251 2.396 5 50 CEBA Cc1ccc(OCC(=O)N2CCCCC2)c([N+](=O)[O-])c1 4841278 XIZAJUCEKNNBSL-UHFFFAOYSA-N 278.308 2.295 5 50 CEBA CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCCC1 5063325 VAHGAIQQOSIPHA-UHFFFAOYSA-N 277.324 2.463 5 50 CEBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2)n1 60291 NDZGLBSMXINCHL-UHFFFAOYSA-N 280.671 2.234 5 50 CEBA O=C(OCc1ccccc1)N1CCC[C@@H]([N+](=O)[O-])CC1 96032011 HMGKXDJEYOSFMV-CYBMUJFWSA-N 278.308 2.454 5 50 CEBA CC[N@@+]12CCC[C@H]3[C@@H]4CCCC(=O)N4C[C@@H](CCC1)[C@H]32 252441088 FFXCRHHKJZTONF-YEAFQPLXSA-N 277.432 2.406 5 50 CEBA biogenic O=[N+]([O-])c1cc(F)ccc1N[C@H](CO)Cc1ccccn1 170610814 YPLYHAOISBEEAH-LBPRGKRZSA-N 291.282 2.144 5 50 CEBA C[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 23115138 XIGGMEHFOAGNCY-GHMZBOCLSA-N 250.298 2.204 5 50 CEBA C[C@@H](C(=O)Nc1ccccc1F)n1cc([N+](=O)[O-])cn1 1421978 RLEPBBDBIGRKHE-QMMMGPOBSA-N 278.243 2.130 5 50 CEBA CCOc1ccccc1Nc1ncnc(N)c1[N+](=O)[O-] 3912558 XNLBZNJMZLLDSC-UHFFFAOYSA-N 275.268 2.109 5 50 CEBA Cc1cc(C(=O)NCc2ccccn2)ccc1[N+](=O)[O-] 183751 CXSRBSJNTBESKJ-UHFFFAOYSA-N 271.276 2.228 5 50 CEBA O=[N+]([O-])c1ccc(I)c(F)c1 1614562 QLAFWGDKYKHVKC-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA CCCCN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 216702864 IGQYVCCHCHUHHP-UHFFFAOYSA-N 272.326 2.161 5 50 CEBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1cccnc1 453472 STMYBOBBWOZTMD-VMPITWQZSA-N 283.287 2.319 5 50 CEBA Cc1c([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cnn1C 1054675 KBPZYILEHNMDNN-SECBINFHSA-N 288.307 2.128 5 50 CEBA COc1cc(C(=O)NC2CCCC2)c([N+](=O)[O-])cc1OC 1190362 HOIXOVLBVRJJNO-UHFFFAOYSA-N 294.307 2.284 5 50 CEBA CSc1ccccc1NC(=O)Cn1ccc([N+](=O)[O-])n1 1070556 BQUCABYAQZTSAL-UHFFFAOYSA-N 292.320 2.152 5 50 CEBA CC(=O)c1c(C)nc(-c2ccc([N+](=O)[O-])cc2)nc1N 441370 UGHHEUOJHKIVBN-UHFFFAOYSA-N 272.264 2.145 5 50 CEBA CCOC(=O)CCCNc1cccc([N+](=O)[O-])c1 3165947 YMTFMJVAJXKVPE-UHFFFAOYSA-N 252.270 2.350 5 50 CEBA Cc1ccc([C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1 252585354 HZBMORQXPWKPQK-OUAUKWLOSA-N 280.349 2.385 5 50 CEBA O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2)c1 20522713 MBUHSMPFSBDIBR-HNNXBMFYSA-N 272.304 2.418 5 50 CEBA CCN1C(=O)S/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C1=O 13940384 RKUGHHFZMRJRLM-POHAHGRESA-N 294.288 2.357 5 50 CEBA O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cnccn1 475220 CVWKUNUDZXXURA-UHFFFAOYSA-N 278.655 2.291 5 50 CEBA Cc1cc(Oc2nc([N+](=O)[O-])nn2C)ccc1Cl 615879 SVVWCMURDGGVPX-UHFFFAOYSA-N 268.660 2.477 5 50 CEBA CNC(=O)C(C)(C)CN[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 170594419 MOWATVHCFBNPCE-LLVKDONJSA-N 293.367 2.326 5 50 CEBA O=c1c([N+](=O)[O-])c[nH]c2c(F)cc(Br)cc12 1857780857 VZCXZFIUAARHMP-UHFFFAOYSA-N 287.044 2.338 5 50 CEBA CC(=O)N1c2ccc([N+](=O)[O-])cc2N(C(C)=O)[C@H](C)[C@@H]1C 4769769 PMTHDUKCVRFGKD-DTWKUNHWSA-N 291.307 2.091 5 50 CEBA CC(C)Nc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 670417728 NMEPKIQMKSFHNF-UHFFFAOYSA-N 269.213 2.022 5 50 CEBA O=[N+]([O-])c1cccc([S@@](=O)CC[C@H]2CCCO2)c1 888097696 YWFUDSBHUMCPRG-ZMZPIMSZSA-N 269.322 2.272 5 50 CEBA CN1CC[C@H]2CCN(c3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1 192558669 XDJXMUCHBUTNLS-IINYFYTJSA-N 279.315 2.264 5 50 CEBA CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 16125211 BHIIECOOMQPQDV-UHFFFAOYSA-N 273.086 2.107 5 50 CEBA in-vitro O=[N+]([O-])c1ccc(C2=N[C@H]3C=CC=C[C@H]3N=C2)cc1 1848442347 CRZSRHJJWDYDSY-OLZOCXBDSA-N 253.261 2.332 5 50 CEBA C[C@@H]1[C@@H]2CCCN2CCN1Cc1cccc([N+](=O)[O-])c1 5032860 SGFDXMPBOGSZRP-DOMZBBRYSA-N 275.352 2.263 5 50 CEBA NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 4310064 ZZCWVIZWCXDOOR-UHFFFAOYSA-N 271.276 2.306 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2 163228259 UGGJSGCXCXYENH-RTXFEEFZSA-N 291.307 2.345 5 50 CEBA C[C@@H]1CCCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-] 333749 LCTNFWXTMUHRBV-SNVBAGLBSA-N 284.337 2.158 5 50 CEBA COc1ccc(NC(=O)C(F)(F)F)c([N+](=O)[O-])c1 4192860 IPUBAUKHSFRTAT-UHFFFAOYSA-N 264.159 2.104 5 50 CEBA CCn1c(S)nnc1-c1cccc([N+](=O)[O-])c1 4865620 OPDJIMWSFJWMHI-UHFFFAOYSA-N 250.283 2.162 5 50 CEBA COC(=O)c1cc([N+](=O)[O-])c(F)cc1Br 35333542 UYTRUAPOXQRIMA-UHFFFAOYSA-N 278.033 2.283 5 50 CEBA in-vitro COC(=O)Cc1ccc([N+](=O)[O-])cc1C(F)(F)F 97756807 XWJUAOQDPPDTSV-UHFFFAOYSA-N 263.171 2.329 5 50 CEBA CC(C)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 4170503 UICCYQOGNIFIEN-UHFFFAOYSA-N 263.341 2.121 5 50 CEBA C[C@@H](C(=O)Nc1cccc(F)c1)n1cc([N+](=O)[O-])cn1 1423700 CPDSRQGKBPVGKX-QMMMGPOBSA-N 278.243 2.130 5 50 CEBA CCCc1nc(Cn2cc([N+](=O)[O-])c(C3CC3)n2)no1 195057080 RNXJXRZUEHLKQX-UHFFFAOYSA-N 277.284 2.053 5 50 CEBA O=c1oc2ccccc2c(N2CCCC2)c1[N+](=O)[O-] 3895942 ADBXTULQWMWTBQ-UHFFFAOYSA-N 260.249 2.301 5 50 CEBA CC(=O)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C 4008030 UDRQDZZEQCXFPF-SECBINFHSA-N 297.742 2.305 5 50 CEBA COc1cc(Nc2cnc[nH]2)c([N+](=O)[O-])cc1OC 225533184 YWSQGPKFPCLVSF-UHFFFAOYSA-N 264.241 2.079 5 50 CEBA C[C@H](NC(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1)c1ccccc1 1423692 PVBFQRCGAKXSAU-WDEREUQCSA-N 288.307 2.230 5 50 CEBA Cc1c(C(=O)NCc2ccco2)cccc1[N+](=O)[O-] 258947 PJVJJNVITAUWGX-UHFFFAOYSA-N 260.249 2.426 5 50 CEBA CC(=O)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 318453 JVTXVSSITAXGJQ-UHFFFAOYSA-N 256.645 2.166 5 50 CEBA C[n+]1cccc(CC[C@@H]2Nc3ccc([N+](=O)[O-])cc3N2)c1 5570452 VATVRKZESPWJAU-OAHLLOKOSA-N 285.327 2.216 5 50 CEBA C[C@@H](C(=O)Nc1ccc(O)c([N+](=O)[O-])c1)c1cccnc1 166075025 DKAPLQGPPZVEDK-SECBINFHSA-N 287.275 2.438 5 50 CEBA O=[N+]([O-])c1ccc(CN2CCC(C3OCCO3)CC2)cc1 110084946 FMSKWAGLGRYOAD-UHFFFAOYSA-N 292.335 2.180 5 50 CEBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1cccc(Cl)c1 1428144 HNYPLMWPPPRVDT-UHFFFAOYSA-N 294.698 2.392 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)NC1CCCCC1 333728 MLDBPBAIRZLOJF-UHFFFAOYSA-N 284.337 2.206 5 50 CEBA O=C(Nc1ncc([N+](=O)[O-])s1)c1cccs1 4217523 ZLOXYEZYWCTXHU-UHFFFAOYSA-N 255.280 2.365 5 50 CEBA in-man O=C(O)c1cccc(Nc2ccncc2[N+](=O)[O-])c1 4187624 ZUWZJQHKYQJMDW-UHFFFAOYSA-N 259.221 2.432 5 50 CEBA COC(=O)CCN=c1ccc2nc3ccccc3n(C)c-2c1 334157022 IHKNZEBNSLDFNS-UHFFFAOYSA-N 295.342 2.142 5 50 CEBA O=[N+]([O-])c1ccc(NCCCN2CCOCC2)c(Cl)c1 19773267 DIVMURZLONPZPK-UHFFFAOYSA-N 299.758 2.382 5 50 CEBA O=C(N[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1n[nH]cc1[N+](=O)[O-] 408031154 KZSAAHVQBGCVFM-OPRDCNLKSA-N 278.312 2.017 5 50 CEBA O=[N+]([O-])c1cc([N+](=O)[O-])c(N2CCCC2)c([N+](=O)[O-])c1 104241902 WTTCYXNMNCOZBS-UHFFFAOYSA-N 282.212 2.011 5 50 CEBA CSC[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1N 170605143 GMNMIYIVIXWRBU-SNVBAGLBSA-N 295.364 2.145 5 50 CEBA N[C@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5127883 JXBSDLZLJPIEJN-UWVGGRQHSA-N 280.284 2.185 5 50 CEBA C[C@H]1[C@H]2CCCN2CCN1Cc1cccc([N+](=O)[O-])c1 5032872 SGFDXMPBOGSZRP-SWLSCSKDSA-N 275.352 2.263 5 50 CEBA CCOc1ccc(Nc2ncnc(N)c2[N+](=O)[O-])cc1 3912557 ISWRFRTUJYTWQI-UHFFFAOYSA-N 275.268 2.109 5 50 CEBA COC(=O)c1cc(Br)cc([N+](=O)[O-])c1 1676683 DDJCZBFPZLYREP-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA in-vitro CON(C)C1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 1615586574 CEWYCCHSTVYZBM-UHFFFAOYSA-N 283.303 2.196 5 50 CEBA CCN(c1ncnc(N)c1[N+](=O)[O-])C1CCCCC1 3912620 SUTSTKXUTYFMGO-UHFFFAOYSA-N 265.317 2.126 5 50 CEBA CCOC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 260276229 AHCPQJTZILYMBN-UHFFFAOYSA-N 288.097 2.463 5 50 CEBA Cc1ccn(C(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 2325901500 IRVAPNIFPDLSPD-UHFFFAOYSA-N 265.656 2.442 5 50 CEBA O=C(CSCc1ccc([N+](=O)[O-])cc1)NC1CC1 452583 RNYRFDYBHZUTCX-UHFFFAOYSA-N 266.322 2.107 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1C[C@@H](C)O 155727866 ZKTHFXFTMDTZRU-NEPJUHHUSA-N 292.335 2.279 5 50 CEBA Cn1nc([N+](=O)[O-])nc1Sc1cccc2cccnc12 376115 GHHDGOWHHDYBAW-UHFFFAOYSA-N 287.304 2.423 5 50 CEBA CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCSC1 241132939 JNJXTOAIOFXDJM-QWHCGFSZSA-N 282.365 2.066 5 50 CEBA C[C@H](C(=O)Nc1ccc(O)c([N+](=O)[O-])c1)c1cccnc1 166074889 DKAPLQGPPZVEDK-VIFPVBQESA-N 287.275 2.438 5 50 CEBA CC(=O)c1cnn(C(=O)Cc2ccc([N+](=O)[O-])cc2)c1C 2325809682 XCENWMLAOXCAMB-UHFFFAOYSA-N 287.275 2.185 5 50 CEBA C[C@@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 20167216 WRAUOSVUGOEMOS-CHWSQXEVSA-N 294.351 2.473 5 50 CEBA O=[N+]([O-])c1cccc(C2N(O)[C@@H]3CCCC[C@H]3N2O)c1 828842391 PTWXTNYVTQSTRA-VXGBXAGGSA-N 279.296 2.301 5 50 CEBA O=C(O)c1cc(Br)c(F)c([N+](=O)[O-])c1 74934291 DEPOWDIDJDBOFC-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA COc1cccc(NC[C@](C)(O)C(F)(F)F)c1[N+](=O)[O-] 274578958 ACFFQEQNXOMEBO-JTQLQIEISA-N 294.229 2.329 5 50 CEBA COc1ccc(C2=CSC3=NCCN23)cc1[N+](=O)[O-] 121999 BQXZLKXELCACIS-UHFFFAOYSA-N 277.305 2.320 5 50 CEBA O=[N+]([O-])c1ccc(N2CCN(Cc3cccnc3)CC2)cc1 54866756 QYLRIGGAIGQGIJ-UHFFFAOYSA-N 298.346 2.312 5 50 CEBA Cc1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])cn2)cc1 1383717 POLPNUJAOPJLTN-UHFFFAOYSA-N 278.289 2.131 5 50 CEBA CC[C@@H]1COC(C)(C)CN1c1ncccc1[N+](=O)[O-] 585090357 COLPCTRIMIKYBC-SNVBAGLBSA-N 265.313 2.384 5 50 CEBA O=C(Cn1nnc2ccccc21)c1ccc([N+](=O)[O-])cc1 41168 XJLCWAVWERRVAR-UHFFFAOYSA-N 282.259 2.222 5 50 CEBA O=C1C[C@H](c2cccc([N+](=O)[O-])c2)Sc2nncn21 447596 MIASPDXXKQUDAV-SECBINFHSA-N 276.277 2.064 5 50 CEBA NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 4755097 PMOAZUXLZVASOZ-UHFFFAOYSA-N 271.276 2.306 5 50 CEBA CC(C)C[C@@H](NSc1ncccc1[N+](=O)[O-])C(=O)O 28631475 QCVUBDSGNDCAAO-MRVPVSSYSA-N 285.325 2.086 5 50 CEBA CCCCNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 5045877 LODDEMCQPHNFSJ-UHFFFAOYSA-N 292.744 2.327 5 50 CEBA Cc1cccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)n1 16309417 YOQWGPXWNZTMTF-UHFFFAOYSA-N 283.243 2.099 5 50 CEBA CC(C)CCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 470474 KNNIUTFMDOHYOO-UHFFFAOYSA-N 262.265 2.237 5 50 CEBA CC1CCN(C(=O)CSc2ccc([N+](=O)[O-])cn2)CC1 6243631 QIPYIXKAQUFRDS-UHFFFAOYSA-N 295.364 2.340 5 50 CEBA C[C@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@H]1C 119131152 LRIHZGMSFLLNRM-IUCAKERBSA-N 264.281 2.171 5 50 CEBA CC1(C)CN(c2ccc3ncccc3c2[N+](=O)[O-])CCN1 212604755 BKJJCXLTCQKKNT-UHFFFAOYSA-N 286.335 2.331 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2cccc(Br)c2)N1 115971 FZHWJJRTEIUGMD-MWLCHTKSSA-N 299.124 2.046 5 50 CEBA O=c1oc2ccccc2c2nc(-c3cnccn3)ncc12 2080385333 AJAINZBUWMZEHM-UHFFFAOYSA-N 276.255 2.193 5 50 CEBA Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)no1 457053 MNSSQQJWADCNIJ-UHFFFAOYSA-N 261.237 2.452 5 50 CEBA O=c1[nH]nc(-c2ccc([N+](=O)[O-])cc2)cc1C(F)(F)F 263619750 UPGFPYUSUWSLPT-UHFFFAOYSA-N 285.181 2.364 5 50 CEBA COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccco1 101730 WOPZPUPZCZSCPU-UHFFFAOYSA-N 262.221 2.449 5 50 CEBA CC[N+]1(CN2C(=O)c3ccccc3C2=O)CCCCC1 392565 HHBQSUOMNGWUPW-UHFFFAOYSA-N 273.356 2.261 5 50 CEBA CC(C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 15021142 CEBPIVWDZLKYQQ-UHFFFAOYSA-N 287.113 2.496 5 50 CEBA in-vitro C[C@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C[C@H](C)O1 4680026 DUUITWYJLMWWKB-BRQSLIGTSA-N 290.319 2.244 5 50 CEBA O=[N+]([O-])c1ccc(N2CCC[C@@H](O)C2)c2ncccc12 4132257 JGUALWJFKXHCJW-SNVBAGLBSA-N 273.292 2.104 5 50 CEBA Cc1cc(C(=O)Nc2ccccc2C(N)=O)ccc1[N+](=O)[O-] 433919 LQSIPNAOCQVDTG-UHFFFAOYSA-N 299.286 2.254 5 50 CEBA Cc1cc(NCc2ncnn2C)c2cc([N+](=O)[O-])ccc2n1 170593996 FHUGWUFDBUACAI-UHFFFAOYSA-N 298.306 2.192 5 50 CEBA CSc1ccc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 103400 KGPRPRLZOPUBMT-PWSUYJOCSA-N 266.322 2.005 5 50 CEBA Cc1ccc[n+](-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 4529931 IURHHEYJEYNGLW-UHFFFAOYSA-N 260.229 2.088 5 50 CEBA CO[C@@H]1[C@H]2C[C@@H]3CN(c4ncc(C)cc4[N+](=O)[O-])[C@H]1[C@H]3C2 286501626 YHUAYXJMPJFGEY-GGFUIZRSSA-N 289.335 2.158 5 50 CEBA CN(CCc1cnc[nH]1)c1ccc([N+](=O)[O-])cc1F 1775994482 ULAPNQZIOCSDGM-UHFFFAOYSA-N 264.260 2.136 5 50 CEBA COC(=O)Cc1cc([N+](=O)[O-])ccc1Br 117203065 GYGZNFZMPAFWMI-UHFFFAOYSA-N 274.070 2.073 5 50 CEBA CN1CC[C@H]2CCN(c3cc(F)ccc3[N+](=O)[O-])[C@H]2C1 248789977 XDJXMUCHBUTNLS-HZMBPMFUSA-N 279.315 2.264 5 50 CEBA CCN1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 22591941 WRIGNECLGKDBLI-UHFFFAOYSA-N 283.759 2.386 5 50 CEBA COC(=O)c1cc2c(=O)c3ccccc3oc2nc1C 1387321 MTSZVZPLJICGIH-UHFFFAOYSA-N 269.256 2.436 5 50 CEBA O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccccc2)cc1 19301144 JDCPMOWSBPLTHF-HNNXBMFYSA-N 272.304 2.418 5 50 CEBA Nc1ccc(N2CCC(c3ncc[nH]3)CC2)c([N+](=O)[O-])c1 283749449 KSTCKAPDSONVKG-UHFFFAOYSA-N 287.323 2.284 5 50 CEBA O=[N+]([O-])c1cnc(N[C@@H]2C[C@@H]3OCCC[C@H]32)s1 253355679 GGUPPSVKOWSVLG-RNJXMRFFSA-N 255.299 2.031 5 50 CEBA Nc1nnc(-c2ccc([N+](=O)[O-])c(Cl)c2)s1 431634 GFMSCCOFBRJELY-UHFFFAOYSA-N 256.674 2.349 5 50 CEBA C[C@@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 20167667 PMKVSECKMYBFLA-VXGBXAGGSA-N 280.324 2.083 5 50 CEBA CCN(C)[C@H]1CCN(c2cc(F)ccc2[N+](=O)[O-])C1 241586410 OVTCWZHSQOQUPC-NSHDSACASA-N 267.304 2.264 5 50 CEBA CCC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 268593996 VHLOEYINWGIWLQ-GFCCVEGCSA-N 277.324 2.326 5 50 CEBA COc1ccc(I)c([N+](=O)[O-])c1F 1772572471 CPOCXDDFPRUBCI-UHFFFAOYSA-N 297.023 2.347 5 50 CEBA Cc1cccc(C(=O)NCc2ccccn2)c1[N+](=O)[O-] 464500 VYAOABNZHCGVIB-UHFFFAOYSA-N 271.276 2.228 5 50 CEBA Cc1ccc([N+](=O)[O-])c(OCCNC[C@H]2CCCO2)c1 4842303 YOWGDBPIQIRHQF-GFCCVEGCSA-N 280.324 2.051 5 50 CEBA CCS(=O)(=O)CCNc1ccc(Cl)cc1[N+](=O)[O-] 225560202 WGEAZKAZSQUCMW-UHFFFAOYSA-N 292.744 2.095 5 50 CEBA Nc1cccc([C@@H](C[N+](=O)[O-])O[C@@H]2CCCCO2)c1 72446984 YYTFIBZARMMTFA-CHWSQXEVSA-N 266.297 2.130 5 50 CEBA COc1cc(C(=O)OCCF)cc([N+](=O)[O-])c1C 170611779 AXBDRXJIAPXDQU-UHFFFAOYSA-N 257.217 2.038 5 50 CEBA Nc1ncnc(NCCc2ccc(Cl)cc2)c1[N+](=O)[O-] 3912532 RYCWHGCAXMYLPS-UHFFFAOYSA-N 293.714 2.275 5 50 CEBA O=[N+]([O-])c1nn(CCN2CCC=C(F)C2)cc1Cl 585133825 WQKXQKWXRPEMBH-UHFFFAOYSA-N 274.683 2.004 5 50 CEBA COc1ccc(C(=O)N2CCC(C)CC2)cc1[N+](=O)[O-] 103413 QBIHBWYAZHBQPA-UHFFFAOYSA-N 278.308 2.476 5 50 CEBA O=C(COc1ccccc1[N+](=O)[O-])Nc1nccs1 115710 NPHCEWQRFBRFAY-UHFFFAOYSA-N 279.277 2.069 5 50 CEBA Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] 4611149 WLOBIKJUNBYPDB-NSHDSACASA-N 298.364 2.466 5 50 CEBA C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 4776679 MFOLKAPJNYBJFJ-UWVGGRQHSA-N 279.296 2.236 5 50 CEBA CC1=NN(c2ncccc2[N+](=O)[O-])C(=O)c2ccccc2O1 4051726 FDLMYIJTUPVQIP-UHFFFAOYSA-N 298.258 2.362 5 50 CEBA O=[N+]([O-])c1cc(Cl)ccc1N1CCN2CC[C@H]1C2 408522842 MLRKYVVHKAWNCQ-JTQLQIEISA-N 267.716 2.143 5 50 CEBA CCn1nc(C)c([N+](=O)[O-])c1N1C[C@@H](C)[C@H](C)C1 280741628 OLHQMQQUJUFCOZ-RKDXNWHRSA-N 252.318 2.212 5 50 CEBA CC1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 4010741 LOPBYMAZDLIPHO-UHFFFAOYSA-N 284.337 2.015 5 50 CEBA Cc1nc(N2CCC=C(c3cnn(C)c3)C2)ccc1[N+](=O)[O-] 888095487 JRFWZYXIZWBUTI-UHFFFAOYSA-N 299.334 2.325 5 50 CEBA O=[N+]([O-])c1cccc2c(I)n[nH]c12 14985808 CVQKINXVUVZMJY-UHFFFAOYSA-N 289.032 2.076 5 50 CEBA C[C@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 4524435 PTSMTPGJTINRMS-KZQRZKTQSA-N 290.319 2.244 5 50 CEBA C[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 271801 IBATUZBCIWHCAC-SNVBAGLBSA-N 284.337 2.158 5 50 CEBA O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccccc2)cc1 1599349 KAHNIMUVMKNJPX-UHFFFAOYSA-N 279.273 2.363 5 50 CEBA CC(C)(C)OC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 34572927 PBUXRZQTDKBQBM-UHFFFAOYSA-N 279.296 2.283 5 50 CEBA COc1c(N)cc(Br)c([N+](=O)[O-])c1F 675050775 XBKCMIWBCDLKMO-UHFFFAOYSA-N 265.038 2.087 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2ccc(C(F)(F)F)cc2)N1 115993 LJCIZWPTTFFJTB-MWLCHTKSSA-N 288.225 2.302 5 50 CEBA O=C(O)[C@H]1CCCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1 4596889 OMUPALOXANKWJW-NEPJUHHUSA-N 292.291 2.424 5 50 CEBA NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCCC1 4755429 OMFFXESCTUPWJZ-UHFFFAOYSA-N 263.297 2.074 5 50 CEBA O=C(NC[C@H]1CCCOC1)c1cccc([N+](=O)[O-])c1Cl 160401393 RPOZFLILNHSDBG-SECBINFHSA-N 298.726 2.405 5 50 CEBA O=[N+]([O-])c1ccc2nc(N3CCOCC3)sc2c1 242022 IXMMDSSNFJJMNS-UHFFFAOYSA-N 265.294 2.041 5 50 CEBA CC(=O)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 4012247 KLMIREBDPKVUQJ-UHFFFAOYSA-N 256.645 2.166 5 50 CEBA in-vitro O=C(CSc1ncccn1)Nc1ccc([N+](=O)[O-])cc1 5012427 MLAKOPQIFFSBSL-UHFFFAOYSA-N 290.304 2.116 5 50 CEBA CCCOc1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 36732389 VEQYJZCKWTZJIN-GQCTYLIASA-N 251.238 2.481 5 50 CEBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 12946771 QWUNRULDLDWOOC-DTORHVGOSA-N 298.726 2.498 5 50 CEBA O=[N+]([O-])c1ccc(-n2nnc3ccccc32)c([N+](=O)[O-])c1 2029397 KJTTXOXWFXOPHJ-UHFFFAOYSA-N 285.219 2.237 5 50 CEBA Cn1ncc2c(O)c3cc4ccccc4nc3nc21 253623705 IDOWGZHEAHUOCI-UHFFFAOYSA-N 250.261 2.375 5 50 CEBA Nc1ccc(CNc2c(F)cc([N+](=O)[O-])cc2F)cn1 170615136 QQBQHZQUGLUZTA-UHFFFAOYSA-N 280.234 2.462 5 50 CEBA Cc1ccc(C)c(NC(=O)Cn2nc([N+](=O)[O-])cc2C)c1 1429403 CHGFCBFWFIJJML-UHFFFAOYSA-N 288.307 2.355 5 50 CEBA Cc1c([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cnn1C 1054676 KBPZYILEHNMDNN-VIFPVBQESA-N 288.307 2.128 5 50 CEBA CC1(C)C[C@@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1 4093736 MBGZTKSUFLIELQ-SECBINFHSA-N 292.291 2.265 5 50 CEBA C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)C1 4905005 YJYYBEHVKIASSE-QWRGUYRKSA-N 298.364 2.261 5 50 CEBA O=[N+]([O-])c1ccc(N2CCOCC2)c(C(F)(F)F)c1 4004500 INQHSXGCAZQBBH-UHFFFAOYSA-N 276.214 2.450 5 50 CEBA CC[C@@H](C)N(CCO)Cc1ccc(C)c([N+](=O)[O-])c1 585117240 VZNXBCJQOXXJNM-GFCCVEGCSA-N 266.341 2.496 5 50 CEBA CCC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1Cl 4725667 SXOQDIKVHQYYBU-UHFFFAOYSA-N 287.728 2.471 5 50 CEBA CC(=O)Nc1ccc(Br)cc1[N+](=O)[O-] 3852528 GUBNCRISSRANNO-UHFFFAOYSA-N 259.059 2.316 5 50 CEBA biogenic O=[N+]([O-])c1ccc(CCN2CCN(CC3CC3)CC2)cc1 298783331 HBJFMLFBRVGMLZ-UHFFFAOYSA-N 289.379 2.165 5 50 CEBA Cc1cccnc1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 362506 UVUPEBBTDBKBLU-UHFFFAOYSA-N 283.243 2.099 5 50 CEBA Cc1cc(NC(=O)N2CC[C@@H](N(C)C)C2)ccc1[N+](=O)[O-] 153647476 SMGOGXZHEUMFDA-GFCCVEGCSA-N 292.339 2.071 5 50 CEBA CCOC(=O)C1CCN(Cc2ccc([N+](=O)[O-])s2)CC1 238738 RXPVAANKJVKBED-UHFFFAOYSA-N 298.364 2.431 5 50 CEBA O=CN[C@H]1CCCc2c1[nH]c1ccc([N+](=O)[O-])cc21 273596 RUELWXLIPDINIR-LBPRGKRZSA-N 259.265 2.200 5 50 CEBA COC(=O)c1ccc(NCC(C)C)c([N+](=O)[O-])c1 83391411 OCDFGCSEERXHCB-UHFFFAOYSA-N 252.270 2.449 5 50 CEBA O=[N+]([O-])c1ccc(NC[C@H]2CCCO2)c([N+](=O)[O-])c1 4082412 VKWUSZOSOIHTOV-SECBINFHSA-N 267.241 2.094 5 50 CEBA C[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 20652764 ADLSEZMBGVDYIG-VXGBXAGGSA-N 280.324 2.083 5 50 CEBA CC(=O)N1CCc2cc(Br)cc([N+](=O)[O-])c21 4336697 RCELVCGNAKOBPO-UHFFFAOYSA-N 285.097 2.266 5 50 CEBA in-vitro O=C(CNC1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 4181884 XMZVUMXCMBGCRM-UHFFFAOYSA-N 277.324 2.456 5 50 CEBA O=C(O)CSc1nc2ccc([N+](=O)[O-])cc2s1 312334 XRPUEHHQKFLQSG-UHFFFAOYSA-N 270.291 2.381 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CCCO1 4652582 RWZRJWJDLSYVMW-LLVKDONJSA-N 250.254 2.021 5 50 CEBA COc1cc(CNC(C)C)c([N+](=O)[O-])cc1OC 4685545 GPRLNFHIZJEIDF-UHFFFAOYSA-N 254.286 2.110 5 50 CEBA CC(C)C[C@@H](CNCc1csc([N+](=O)[O-])c1)C(=O)O 263050166 KRWPPVUENMZGBX-JTQLQIEISA-N 286.353 2.493 5 50 CEBA Cc1cc(C(=O)NCc2ccco2)ccc1[N+](=O)[O-] 34204 YVPBBDGTHJVCGY-UHFFFAOYSA-N 260.249 2.426 5 50 CEBA COc1ccc(/C=C2/[C@@H](O)C3CCN2CC3)cc1[N+](=O)[O-] 4832208 LAZPCIJLAUPZMJ-CTXBLAANSA-N 290.319 2.031 5 50 CEBA CCO[C@H](C)n1cc([N+](=O)[O-])c(Br)n1 616567828 DIGNCMYDOXOTGL-RXMQYKEDSA-N 264.079 2.109 5 50 CEBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccccc1 188523 IYJLTOTUYACXLP-UHFFFAOYSA-N 282.255 2.391 5 50 CEBA COc1cc(Br)c([N+](=O)[O-])c(OC)c1 84192842 KODPKAQPETYBEG-UHFFFAOYSA-N 262.059 2.375 5 50 CEBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2ccc(Br)cc2)N1 221457 VYMIHEBRKGBIJG-MWLCHTKSSA-N 299.124 2.046 5 50 CEBA CCOC(=O)C1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 128542 UGBJPCXWAAKYKZ-UHFFFAOYSA-N 292.335 2.370 5 50 CEBA Cc1nn([C@@H](C)C(=O)N2CCCCCC2)c(C)c1[N+](=O)[O-] 2884908 OABMVQWSKKQOOH-LBPRGKRZSA-N 294.355 2.372 5 50 CEBA Cc1c([N+](=O)[O-])cc([N+](=O)[O-])c(C)c1N1CCCC1=O 2900710 WLUIOMCNMUOVOX-UHFFFAOYSA-N 279.252 2.247 5 50 CEBA O=[N+]([O-])c1ccc(O[P@](=O)(O)c2ccccc2)cc1 4352629 NRGZTHQFAQCJCQ-UHFFFAOYSA-N 279.188 2.485 5 50 CEBA in-vitro Cc1cc(C)n(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1 1594415 UMBVNCGCAYHVJO-UHFFFAOYSA-N 262.225 2.306 5 50 CEBA CC1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1 1751693 OPFLUGYNSONUMU-UHFFFAOYSA-N 293.279 2.375 5 50 CEBA O=[N+]([O-])[C@H](c1ccccc1)S(=O)(=O)c1ccccc1 2173058 NXYDACGBBYORBZ-ZDUSSCGKSA-N 277.301 2.436 5 50 CEBA Cc1nc2c([N+](=O)[O-])c(Cl)c([N+](=O)[O-])cc2[nH]1 71772801 QELMPUBBJRCJSR-UHFFFAOYSA-N 256.605 2.341 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[C@H](C)O 155727975 ZKTHFXFTMDTZRU-NWDGAFQWSA-N 292.335 2.279 5 50 CEBA CCc1noc(C)c1NC(=O)c1cc([N+](=O)[O-])ccc1N 170605152 BBDYPCJNDYXLAY-UHFFFAOYSA-N 290.279 2.288 5 50 CEBA COC(=O)c1cc(Br)ccc1[N+](=O)[O-] 15442070 IXVNSGSUEVSJIF-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA in-vitro CCOC(=O)c1cc(Br)c(N)c([N+](=O)[O-])c1 33607125 QANVLXVFIRTXFG-UHFFFAOYSA-N 289.085 2.116 5 50 CEBA in-vitro O=[N+]([O-])c1cccc(-c2ncn(CCOCC(F)F)n2)c1 225441148 XDBKCMOAGDNTHN-UHFFFAOYSA-N 298.249 2.135 5 50 CEBA O=C1Cc2ccccc2[C@@H](c2ccc([N+](=O)[O-])cc2)N1 439784 WMHPIFSNJWOQCZ-OAHLLOKOSA-N 268.272 2.357 5 50 CEBA C[C@H]1Cn2c(nnc2-c2cccc([N+](=O)[O-])c2)S1 1059891 OLKUVDRWIDXPKM-ZETCQYMHSA-N 262.294 2.348 5 50 CEBA CC[C@@H](O[N+](=O)[O-])c1cc2c(cc1[N+](=O)[O-])OCCO2 3624127 WFAWVMCQKPCFFF-SECBINFHSA-N 284.224 2.025 5 50 CEBA CN(C)[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)C12CCC2 585118032 VBEWEWPLHWPEJD-NWDGAFQWSA-N 276.340 2.275 5 50 CEBA O=C(N[S@](=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 1515341 YXZYHEOOUQOCJD-FQEVSTJZSA-N 290.300 2.047 5 50 CEBA CCc1ccc(Oc2ncnc(N)c2[N+](=O)[O-])cc1 3912742 YDBRXDUVEPGQTN-UHFFFAOYSA-N 260.253 2.322 5 50 CEBA Cc1cc(-n2nc3ccccc3n2)c(O)c([N+](=O)[O-])c1 35828730 SFTUROBOXVSXCX-UHFFFAOYSA-N 270.248 2.343 5 50 CEBA O=C(Cn1nnc2ccccc21)c1cccc([N+](=O)[O-])c1 2762280 AXIWHINCFFOMFK-UHFFFAOYSA-N 282.259 2.222 5 50 CEBA C[C@@H]1CN(CCCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 20652795 OUVPJANJTOYHRA-CHWSQXEVSA-N 294.351 2.473 5 50 CEBA CN(C)[C@@]1(C)CCN(c2sccc2[N+](=O)[O-])C1 1875275246 JJSYRPQIEHNGAM-NSHDSACASA-N 255.343 2.187 5 50 CEBA Cc1cc(F)ccc1[C@H](O)Cn1nc([N+](=O)[O-])cc1C 170078242 RQYCYWIFZBWICJ-GFCCVEGCSA-N 279.271 2.281 5 50 CEBA Cn1nnnc1SCc1c(Cl)cccc1[N+](=O)[O-] 5065665 DKXBRYLPICWKFH-UHFFFAOYSA-N 285.716 2.064 5 50 CEBA C/C=C(C(=C/CC)\OCCNC[C@@H]1CCCO1)/[N+](=O)[O-] 1857667085 VMNRHDMQHYDVPJ-RTOWBJDISA-N 284.356 2.246 5 50 CEBA O=C(OCc1ccc([N+](=O)[O-])cc1)c1cccnc1 3156488 YBJNRPWHPSFTCV-UHFFFAOYSA-N 258.233 2.347 5 50 CEBA O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccco1 209648 MIORSUALLXHFAV-UHFFFAOYSA-N 260.249 2.047 5 50 CEBA Cn1ncc(Cl)c1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 1002309 OFHKOFRXUZZUEX-UHFFFAOYSA-N 298.661 2.373 5 50 CEBA O=[N+]([O-])c1cnn(COc2ccccc2Cl)c1 2537004 NGFYOPHOPKIKBS-UHFFFAOYSA-N 253.645 2.481 5 50 CEBA CN1CCC(N(C)Cc2ccccc2[N+](=O)[O-])CC1 239833 PNBURNGHHRAYHU-UHFFFAOYSA-N 263.341 2.121 5 50 CEBA Cc1cc([N+](=O)[O-])c(N2CCCC2)c([N+](=O)[O-])c1 3879991 VQGQQGHLIBHAHP-UHFFFAOYSA-N 251.242 2.412 5 50 CEBA CN1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 4988841 YYTUBUJHTGVGJR-QPJJXVBHSA-N 275.352 2.246 5 50 CEBA Cc1cc([N+](=O)[O-])cnc1N(C)CC(=O)OC(C)(C)C 180118696 WNPBXIBKZNTFQI-UHFFFAOYSA-N 281.312 2.076 5 50 CEBA COc1cn(C)nc1[C@@H](C)Nc1ccc([N+](=O)[O-])c(C)n1 952992537 HVJRIXOPGMTSSJ-SECBINFHSA-N 291.311 2.213 5 50 CEBA O=[N+]([O-])c1ccc(OCCCn2cnc(Cl)n2)cc1 253426043 MRKBZCBQMXXIQF-UHFFFAOYSA-N 282.687 2.309 5 50 CEBA Cc1ccnc(NCc2nc(C)c(C)[nH]2)c1[N+](=O)[O-] 952963905 NFWRIOQGRGMELS-UHFFFAOYSA-N 261.285 2.250 5 50 CEBA O=C(N[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1n[nH]cc1[N+](=O)[O-] 408031151 KZSAAHVQBGCVFM-IVZWLZJFSA-N 278.312 2.017 5 50 CEBA O=c1sc2ccccc2c(N2CCOCC2)c1[N+](=O)[O-] 4593970 QDDWUXMLUIAZJR-UHFFFAOYSA-N 292.316 2.006 5 50 CEBA O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCCC1 4881946 UNVAJDYDZFWWOI-UHFFFAOYSA-N 289.335 2.431 5 50 CEBA CCOC(=O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)c1 468705 GTPOSQIRZIWRJO-UHFFFAOYSA-N 275.264 2.021 5 50 CEBA Cc1c(NC(=O)NC[C@H](C)CN(C)C)cccc1[N+](=O)[O-] 585086460 HUGAAMZQRQZELJ-JTQLQIEISA-N 294.355 2.222 5 50 CEBA NCCCNc1ccc([N+](=O)[O-])cc1C(F)(F)F 4663007 XIUIJVYLNXWBFZ-UHFFFAOYSA-N 263.219 2.374 5 50 CEBA C[C@@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@@H]1C 119130814 LRIHZGMSFLLNRM-RKDXNWHRSA-N 264.281 2.171 5 50 CEBA O=[N+]([O-])c1cc(Cl)ccc1OCCC1OCCO1 163536991 DUUMGNGMIPUFLG-UHFFFAOYSA-N 273.672 2.390 5 50 CEBA Cc1nn2c(c1[N+](=O)[O-])NCC[C@H]2C(F)(F)F 1857783071 MXSHMNCOYOWICR-YFKPBYRVSA-N 250.180 2.019 5 50 CEBA O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccco1 4703584 PFAUFOBYFVSYOJ-UHFFFAOYSA-N 275.264 2.030 5 50 CEBA COc1c(Br)cc(C(=O)O)cc1[N+](=O)[O-] 20227870 WYCKROZPOJCKCA-UHFFFAOYSA-N 276.042 2.064 5 50 CEBA in-vitro Cc1c(C(=O)O)cc(Br)cc1[N+](=O)[O-] 14982940 DXUUJILVHXQDCV-UHFFFAOYSA-N 260.043 2.364 5 50 CEBA O=C1[C@H]2CCCC[C@@H]2C(=O)N1c1cccc([N+](=O)[O-])c1 100429105 LKICUDFVTNUZQZ-RYUDHWBXSA-N 274.276 2.274 5 50 CEBA C[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)[C@H](O)c1ccccc1)C2 100012628 WKWOJBUWWZTUQV-FXUDXRNXSA-N 290.383 2.033 5 50 CEBA in-man O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCc1ccccn1 188215 LGXVMOYLULKBOI-RMKNXTFCSA-N 297.314 2.362 5 50 CEBA O=C(O)/C=C/c1cc([N+](=O)[O-])ccc1OC(F)F 2582763 ZVXIUSJYFBEUPM-DAFODLJHSA-N 259.164 2.294 5 50 CEBA COc1cc(NC2CCN(C)CC2)c([N+](=O)[O-])cc1C 394461750 PAVVWNXBGLMGMZ-UHFFFAOYSA-N 279.340 2.418 5 50 CEBA Cc1c(N2C(=O)c3cccnc3C2=O)cccc1[N+](=O)[O-] 99925 OLRPSLGEZKYTQC-UHFFFAOYSA-N 283.243 2.099 5 50 CEBA Cn1ccnc1SCC(=O)c1ccc([N+](=O)[O-])cc1 187598 BSFNPKZIDMCGOY-UHFFFAOYSA-N 277.305 2.303 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)c1ccccc1 247943 GKNMUCPEXSCGKC-UHFFFAOYSA-N 263.274 2.428 5 50 CEBA in-vivo CCOc1cc(NCCOC(=O)C2CC2)ccc1[N+](=O)[O-] 225812892 UCIFPJLVVAJXFL-UHFFFAOYSA-N 294.307 2.359 5 50 CEBA COC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4818942 GOHCTKOJCLFFQD-UHFFFAOYSA-N 278.186 2.199 5 50 CEBA O=[N+]([O-])c1ccc(N2CCC(O)CC2)c2ncccc12 38537332 ROLSKNAOHRRYNI-UHFFFAOYSA-N 273.292 2.104 5 50 CEBA in-vitro C[C@H]1CCNC(=O)[C@H]1Nc1ccc(Cl)cc1[N+](=O)[O-] 193519411 QABJXSMURHCCII-CPCISQLKSA-N 283.715 2.185 5 50 CEBA CN1CC[C@@H]2[C@@H](CCN2Cc2cccc([N+](=O)[O-])c2)C1 221747879 IYCFHXCRFYYJHY-DZGCQCFKSA-N 275.352 2.121 5 50 CEBA O=Cc1cc([N+](=O)[O-])ccc1Sc1ncccn1 467728 CQYVXMJILJPMMR-UHFFFAOYSA-N 261.262 2.349 5 50 CEBA CCOC(=O)CC(=O)c1ccc([N+](=O)[O-])cc1Cl 71772186 UEFBRQBDPZDWFJ-UHFFFAOYSA-N 271.656 2.384 5 50 CEBA O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCCC1 83795456 BYDCTERGTGENLU-UHFFFAOYSA-N 254.673 2.484 5 50 CEBA COc1cc(I)ccc1[N+](=O)[O-] 95217811 HIXMWPAZDDJWNC-UHFFFAOYSA-N 279.033 2.208 5 50 CEBA in-vitro CCOC(=O)c1cc(NC2CC2)c(F)cc1[N+](=O)[O-] 725261680 BPTBZHLKPLWKRW-UHFFFAOYSA-N 268.244 2.485 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CC(O)(C2CC2)C1 170091576 LXHFTLJHLCZGEP-HWKANZROSA-N 274.320 2.065 5 50 CEBA C[C@H]1CCN(c2ncc([N+](=O)[O-])c(N3CC[C@H](C)C3)n2)C1 585092761 MQXXDFGQZSBDLL-QWRGUYRKSA-N 291.355 2.077 5 50 CEBA O=[N+]([O-])c1cnn(C[C@H]2CCC[C@@H](C(F)(F)F)O2)c1 901457226 VAPBQVOONCJUQP-BDAKNGLRSA-N 279.218 2.291 5 50 CEBA C[C@@H](C(=O)N[C@H](C)c1ccccc1)n1cc([N+](=O)[O-])cn1 1423695 PVBFQRCGAKXSAU-MNOVXSKESA-N 288.307 2.230 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H]1CO 4985395 HTLIFIOVEGAHAR-VUUYWXRKSA-N 262.309 2.065 5 50 CEBA CCCCOc1ccccc1[C@H]1NC(=O)CC[C@H]1[N+](=O)[O-] 4152258 ATMZHVLDKMDMSD-IUODEOHRSA-N 292.335 2.462 5 50 CEBA O=[N+]([O-])c1cccnc1N1CCC(Cc2ncc[nH]2)CC1 364903625 FEWFYQBNFWESPO-UHFFFAOYSA-N 287.323 2.172 5 50 CEBA NC(=O)c1cc(Cl)c(Br)cc1[N+](=O)[O-] 216709485 QNIGUDSBSUKTTI-UHFFFAOYSA-N 279.477 2.110 5 50 CEBA Cn1cc2cc(Br)cc([N+](=O)[O-])c2n1 95743237 VCQVEMOPFJMGMH-UHFFFAOYSA-N 256.059 2.244 5 50 CEBA O=[N+]([O-])c1ccc(N2CC[C@H](O)[C@H]3CCCC[C@@H]32)nc1 601252600 NWDPTNKAISWRJG-AVGNSLFASA-N 277.324 2.120 5 50 CEBA Cc1ccccc1CCCn1ccc(N)c([N+](=O)[O-])c1=O 585122919 IVROZZRRNXEWIV-UHFFFAOYSA-N 287.319 2.280 5 50 CEBA CC[C@H](O[N+](=O)[O-])c1cc2c(cc1[N+](=O)[O-])OCCO2 3624125 WFAWVMCQKPCFFF-VIFPVBQESA-N 284.224 2.025 5 50 CEBA C[N+](C)(C)[C@@H]1[C@H]2CC[C@@H]3[C@H]2[C@H]2[C@H]1CC[C@H]2[C@@H]3[N+](C)(C)C 257356192 GRVSLICFPDXWRA-MKIGVWGGSA-N 278.484 2.448 5 50 CEBA O=C(COc1ccccc1)Nc1ccc([N+](=O)[O-])cc1O 5049456 PZTWAHGBGTWVEB-UHFFFAOYSA-N 288.259 2.318 5 50 CEBA O=c1[nH]c(/C=C\c2cccc(Cl)c2)nc(O)c1[N+](=O)[O-] 13124695 RFNIDZBAUPURJR-PLNGDYQASA-N 293.666 2.208 5 50 CEBA C[C@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1 4406362 XPYGLMJMRRVFAU-QMMMGPOBSA-N 289.257 2.412 5 50 CEBA O=[N+]([O-])c1c[nH]ccc1=NC[C@H]1COCc2ccccc21 1875299806 WQQBUSDMXKELQG-LBPRGKRZSA-N 285.303 2.138 5 50 CEBA N=c1c2c(=O)oc3ccccc3c2ccn1C[C@@H]1CCCO1 1848442786 JIWIOYIYCZHTAJ-NSHDSACASA-N 296.326 2.406 5 50 CEBA O=[N+]([O-])c1ccc2c(c1)nc(CO)n2Cc1ccccc1 292950 AIFMIOUEZIFEAH-UHFFFAOYSA-N 283.287 2.485 5 50 CEBA Cn1nc([N+](=O)[O-])nc1Oc1ccc(Br)cc1 528377 WJVNMMOTPZPDTL-UHFFFAOYSA-N 299.084 2.278 5 50 CEBA C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)C[C@H](C2CC2)O1 408521036 GBFFIWCBVMDXBT-PRHODGIISA-N 281.287 2.133 5 50 CEBA COc1cc([N+](=O)[O-])c(NC(C)=O)cc1Br 4783362 WFVRYIASUVEKMY-UHFFFAOYSA-N 289.085 2.324 5 50 CEBA in-vitro CCCN(C/C=C/c1ccccc1[N+](=O)[O-])CCO 4988203 QEQDDDFQZYWKCB-FNORWQNLSA-N 264.325 2.312 5 50 CEBA CN(CCNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 10113692 RQJQAPNYAUQFRD-UHFFFAOYSA-N 299.330 2.461 5 50 CEBA CCn1cc(CN(C)C(=O)c2ccccc2[N+](=O)[O-])cn1 371013 FKJLDTGCXFDLJR-UHFFFAOYSA-N 288.307 2.083 5 50 CEBA COc1ccc(C(=O)NCc2ccco2)cc1[N+](=O)[O-] 284764 LKCHGRWXILFKCA-UHFFFAOYSA-N 276.248 2.126 5 50 CEBA CCc1nnc2n1N=C(c1cccc([N+](=O)[O-])c1)CS2 501836 CJAFELBTDCZKJX-UHFFFAOYSA-N 289.320 2.107 5 50 CEBA O=C(c1ccc([N+](=O)[O-])cc1)n1nnc2ccccc21 101953 QVSHSQXCFXHFMN-UHFFFAOYSA-N 268.232 2.028 5 50 CEBA CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)C[C@H]1C 4949555 VOYRQZQPJJBYLD-SNVBAGLBSA-N 295.314 2.181 5 50 CEBA COC(=O)c1ccc(Br)c([N+](=O)[O-])c1 2566616 BNNDHGPPQZVKMX-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA in-vitro O=[N+]([O-])c1cc(I)ccc1F 15443771 KUJTZQXHTBKAMO-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA in-vitro Cc1ccnc(NC2CC(Cn3ccnc3)C2)c1[N+](=O)[O-] 1776005143 CAGHTBLTRIRUHG-UHFFFAOYSA-N 287.323 2.385 5 50 CEBA O=[N+]([O-])c1ccccc1Cn1nnc2ccccc21 15776424 VPYJATNURUKOLZ-UHFFFAOYSA-N 254.249 2.388 5 50 CEBA O=C(Nc1nc2ccc([N+](=O)[O-])cc2s1)[C@H]1CCCO1 375981 JPSIHHYQIJOCMN-SECBINFHSA-N 293.304 2.322 5 50 CEBA CCOC(=O)C[C@@H](C[N+](=O)[O-])c1ccccc1OC 35287636 XWJLFKQKXXOWHQ-JTQLQIEISA-N 267.281 2.009 5 50 CEBA Cn1cnnc1[C@H]1CCCN1c1cccc(F)c1[N+](=O)[O-] 271011471 DHJQXNVZANCTCO-LLVKDONJSA-N 291.286 2.204 5 50 CEBA CCOC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C 4599229 AWGPZWOTFJEJAN-UHFFFAOYSA-N 280.280 2.185 5 50 CEBA CO[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1O)C(C)(C)C 155700808 QYBRWLGHUYNFAA-LLVKDONJSA-N 296.323 2.091 5 50 CEBA O=C1c2ccccc2C(=O)N1Cc1ccc([N+](=O)[O-])c(O)c1 670432785 OZJMOZBUXIBEKK-UHFFFAOYSA-N 298.254 2.097 5 50 CEBA O=[N+]([O-])c1cc(I)cc([N+](=O)[O-])c1 1668820 AISNAASNOWRWIR-UHFFFAOYSA-N 294.004 2.108 5 50 CEBA C[C@H]1C(=O)C(C)(C)C(=O)O[C@@H]1c1ccc([N+](=O)[O-])cc1 182547 LBIIJNHUKQSKIJ-KCJUWKMLSA-N 277.276 2.424 5 50 CEBA O=[N+]([O-])/C=C/c1cc2c(cc1Br)OCCO2 1857796580 IQEODZIPASFRRI-OWOJBTEDSA-N 286.081 2.468 5 50 CEBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)OC[C@H]1CCCO1 451540 OPZNMJNEAWBGBY-KTRBRXNASA-N 277.276 2.330 5 50 CEBA Nc1cc(N2CCCCC2)c([N+](=O)[O-])cc1[N+](=O)[O-] 16383100 ZPSOJOFPFHVPBV-UHFFFAOYSA-N 266.257 2.076 5 50 CEBA O=[N+]([O-])c1cccc2[nH]nc(I)c12 14983392 AOTAXYVEONHYHY-UHFFFAOYSA-N 289.032 2.076 5 50 CEBA in-vitro O=[N+]([O-])c1ccc(NCCN2CC=CCC2)c(F)c1 225461831 JDYRVCPLRVLQNG-UHFFFAOYSA-N 265.288 2.408 5 50 CEBA CC[N+](CC)(CC)CCON1C(=O)c2ccccc2C1=O 406813 XQOZCJMYUBSBFR-UHFFFAOYSA-N 291.371 2.091 5 50 CEBA COC(=O)c1ccc(Br)cc1[N+](=O)[O-] 38537042 YTWDMAAPIWOIFZ-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA O=C(N=c1[nH]c2ccccc2[nH]1)c1cccc([N+](=O)[O-])c1 5033955 QPKROMNIEAEFQA-UHFFFAOYSA-N 282.259 2.145 5 50 CEBA in-vivo Cc1cc(NC2CC(O)(C(F)(F)F)C2)ncc1[N+](=O)[O-] 685945046 QJJILGVTBOFQJU-UHFFFAOYSA-N 291.229 2.166 5 50 CEBA CCN(C(=O)Cn1c([N+](=O)[O-])cnc1C)c1ccccc1 94383 YYDSWDZCJBCUQN-UHFFFAOYSA-N 288.307 2.153 5 50 CEBA CC[C@@H](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)O 4918843 GRWPYFLGAQXKGF-VIFPVBQESA-N 280.280 2.424 5 50 CEBA Cc1cc(I)c(N)c([N+](=O)[O-])c1 95635051 MCALXGRQNXDTPI-UHFFFAOYSA-N 278.049 2.090 5 50 CEBA in-vitro CCCCn1nnc2c(=O)oc3ccc([N+](=O)[O-])cc3c21 4007343 NCZJPEQCCBFIOU-UHFFFAOYSA-N 288.263 2.246 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CCCO1 4652581 RWZRJWJDLSYVMW-NSHDSACASA-N 250.254 2.021 5 50 CEBA O=C(O)c1ccn(COc2ccc([N+](=O)[O-])cc2Cl)n1 2535569 QIGBFIITMBVCLI-UHFFFAOYSA-N 297.654 2.179 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2cccc(Br)c2)N1 115964 FZHWJJRTEIUGMD-GXSJLCMTSA-N 299.124 2.046 5 50 CEBA Cc1ccnc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 299023 YQGNPJJGAAILMG-UHFFFAOYSA-N 271.276 2.479 5 50 CEBA COc1cc(NC(C)=O)c2ncccc2c1[N+](=O)[O-] 4649163 LFMFPPMRNZXSJO-UHFFFAOYSA-N 261.237 2.110 5 50 CEBA COc1cc(CN2CCSCC2)c([N+](=O)[O-])cc1OC 55543531 AHKUTGYREKAVPH-UHFFFAOYSA-N 298.364 2.161 5 50 CEBA O=[N+]([O-])c1cnc(N2CCC[C@@H](OCC3CC3)C2)s1 242164662 WWVAWRJQMCWNTM-SNVBAGLBSA-N 283.353 2.447 5 50 CEBA O=[N+]([O-])[C@@H](c1ccccc1)S(=O)(=O)c1ccccc1 2173060 NXYDACGBBYORBZ-CYBMUJFWSA-N 277.301 2.436 5 50 CEBA Cc1nn([C@H](C)c2nnc3n2CCCCC3)cc1[N+](=O)[O-] 72334166 DOXJGTDWCFOOQX-SNVBAGLBSA-N 290.327 2.027 5 50 CEBA CO[C@H]1CN(c2cc(N)ccc2[N+](=O)[O-])CC[C@@H]1C 193523887 PZSMCUDMKBDLPW-ZANVPECISA-N 265.313 2.038 5 50 CEBA C[C@@H]1C=CC[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]21 17987996 PBLZWGAYCWXFBV-JIMOISOXSA-N 286.287 2.296 5 50 CEBA COC[C@H](C)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 457263 QJLHCIBZGOUTAQ-ZETCQYMHSA-N 272.688 2.013 5 50 CEBA CC(C)(C)NCCNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 139382061 XXGJWVFODMJKAO-UHFFFAOYSA-N 299.758 2.366 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCCN(C)CC1 162759321 HGVBFKDBYLOSND-UHFFFAOYSA-N 292.339 2.073 5 50 CEBA CN1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 207626 FOPDEDXTBCHOMR-UHFFFAOYSA-N 283.759 2.386 5 50 CEBA COc1cc(C=O)ccc1Cn1cc(Cl)c([N+](=O)[O-])n1 13331342 FJWDXLCGORKRHA-UHFFFAOYSA-N 295.682 2.314 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)cc1 101597391 YUFKLKBIXHGELG-OUJBWJOFSA-N 296.348 2.062 5 50 CEBA CSCCCNC(=O)c1ccc(F)cc1[N+](=O)[O-] 131176216 LQFYLNRSUOVKOA-UHFFFAOYSA-N 272.301 2.217 5 50 CEBA Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1 4240517 INKGKPCLQCFQKB-UHFFFAOYSA-N 257.249 2.429 5 50 CEBA in-vitro COC[C@@H](C)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 457264 QJLHCIBZGOUTAQ-SSDOTTSWSA-N 272.688 2.013 5 50 CEBA CON(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C1CCCC1 120472268 RSIBRMGIJMYIHT-UHFFFAOYSA-N 280.280 2.247 5 50 CEBA O=C(O)c1c(F)ccc([N+](=O)[O-])c1Br 94986216 WOFZANBTJXHQEB-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA C[C@]1(NC(=O)c2cc(F)ccc2[N+](=O)[O-])CCCOC1 221706114 NEBRZGDWPJYFQL-ZDUSSCGKSA-N 282.271 2.033 5 50 CEBA Cc1ccc(NC(=S)NC[C@@H]2CCCO2)c([N+](=O)[O-])c1 5041672 VHLLXHBNDVFGEB-JTQLQIEISA-N 295.364 2.369 5 50 CEBA COC(=O)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 5700903 WFQOIJIXNFOYCM-UHFFFAOYSA-N 263.171 2.329 5 50 CEBA in-vitro Cc1c(NC(=O)[C@H]2CCCO2)cccc1[N+](=O)[O-] 617343 NTAMBYZQSQQPNV-LLVKDONJSA-N 250.254 2.021 5 50 CEBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccncc1 2748197 HAOCJZIAGQDETC-UHFFFAOYSA-N 261.212 2.381 5 50 CEBA C[C@@H](C(=O)Nc1ccc(F)cc1F)n1cc([N+](=O)[O-])cn1 1423795 MRTBKZHSRLIADM-ZETCQYMHSA-N 296.233 2.269 5 50 CEBA COc1cc(Cn2cc(F)ccc2=O)c([N+](=O)[O-])cc1F 190728665 DFBWZHHNJVSKQK-UHFFFAOYSA-N 296.229 2.092 5 50 CEBA CC(C)N(C(=O)Cn1cc([N+](=O)[O-])cn1)C1CC(C)(C)C1 408520478 HGHGELKODMZEGA-UHFFFAOYSA-N 294.355 2.217 5 50 CEBA CC(C)c1ccc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 107300 KAELMYGEWHEWBH-OCCSQVGLSA-N 262.309 2.406 5 50 CEBA NC(=O)Cn1c2ccccc2c2nc3ccccc3nc21 119724 GVSRMFMDWQVYLZ-UHFFFAOYSA-N 276.299 2.223 5 50 CEBA CCC(=O)NC(=S)Nc1cccc([N+](=O)[O-])c1C 586851 SWHXFZGRICIKEU-UHFFFAOYSA-N 267.310 2.126 5 50 CEBA Cc1ccnc(NC2CC(Cn3cccn3)C2)c1[N+](=O)[O-] 1776005966 KYYOWGKVPZZKJG-UHFFFAOYSA-N 287.323 2.385 5 50 CEBA COc1cccc(Cn2nc(C)c([N+](=O)[O-])c2C)c1 614340 FVSMDLMYXQMBPZ-UHFFFAOYSA-N 261.281 2.465 5 50 CEBA CN(C)CCN(C)C/C=C/c1ccccc1[N+](=O)[O-] 2893927 WIOJFTGLCXQZJS-SOFGYWHQSA-N 263.341 2.101 5 50 CEBA O=C(O)c1cc(F)c(Br)cc1[N+](=O)[O-] 21981678 JZVCMOJSPCGLTC-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA in-vitro O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nccs1 509576 LZPKBEPSQMEWSY-UHFFFAOYSA-N 279.277 2.069 5 50 CEBA CC1(C)N([O])C(c2ccc([N+](=O)[O-])cc2)=[N+]([O-])C1(C)C 100740363 BVNMZQREQCFTOC-UHFFFAOYSA-N 278.288 2.070 5 50 CEBA O=C(c1cc([N+](=O)[O-])ccc1F)N1CCCCC1 37286041 NFZUQVFAGMYXHI-UHFFFAOYSA-N 252.245 2.360 5 50 CEBA CCn1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)n1 355719 SGZHLIJXOKUTPI-UHFFFAOYSA-N 290.279 2.072 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)NCCCF 123097363 YWGQWACFYXYKBH-UHFFFAOYSA-N 271.248 2.085 5 50 CEBA Cn1cncc1-c1noc(-c2ccc([N+](=O)[O-])cc2)n1 225553157 JOWGDMPCCSNTJH-UHFFFAOYSA-N 271.236 2.045 5 50 CEBA C[C@@H]1CCNC(=O)[C@@H]1Nc1ccc(Cl)cc1[N+](=O)[O-] 193519368 QABJXSMURHCCII-RDDDGLTNSA-N 283.715 2.185 5 50 CEBA CCC1(CC)CNC(=O)[C@H]1Nc1ccc([N+](=O)[O-])c(C)n1 928995611 DBLDTCZGZNCRTM-GFCCVEGCSA-N 292.339 2.015 5 50 CEBA C[C@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 13153571 PMKVSECKMYBFLA-TXEJJXNPSA-N 280.324 2.083 5 50 CEBA O=C(C[C@H]1CCCCO1)Nc1ccc(O)c([N+](=O)[O-])c1 166101650 YQLTWFPCAOBEIT-SNVBAGLBSA-N 280.280 2.198 5 50 CEBA CC(C)CCNC(=O)Cc1ccc([N+](=O)[O-])cc1 442520 YDXWXZMZXUWCMU-UHFFFAOYSA-N 250.298 2.300 5 50 CEBA CC(C)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517308 AYLCDVYHZOZQKM-SNVBAGLBSA-N 283.240 2.024 5 50 CEBA Nc1ccc(-c2n[nH]c(=O)c3ccccc23)cc1[N+](=O)[O-] 9007751 AOALQZIZSREBQY-UHFFFAOYSA-N 282.259 2.081 5 50 CEBA C[C@@H]1C(=O)N(c2ccc([N+](=O)[O-])cc2)C(=O)N1C1CCC1 192414917 GEMVASKGALORAR-SECBINFHSA-N 289.291 2.304 5 50 CEBA Nc1cc([N+](=O)[O-])cc(S(=O)(=O)Cc2ccccc2)c1 34924680 DJLLPNLKTNURMT-UHFFFAOYSA-N 292.316 2.151 5 50 CEBA CCCCN(c1ccc([N+](=O)[O-])cc1)S(C)(=O)=O 216703420 XZHWEGKCBMWXDL-UHFFFAOYSA-N 272.326 2.161 5 50 CEBA C[C@@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C[C@@H](C)O1 463947 DUUITWYJLMWWKB-IDDPWSFUSA-N 290.319 2.244 5 50 CEBA Cc1c(NC(=O)[C@@H]2CCCO2)cccc1[N+](=O)[O-] 617344 NTAMBYZQSQQPNV-NSHDSACASA-N 250.254 2.021 5 50 CEBA Cc1cc(Cl)c(=O)n(-c2ccc([N+](=O)[O-])cc2)n1 3086178 MJKYPBHFXKJSCH-UHFFFAOYSA-N 265.656 2.103 5 50 CEBA Cc1ccnc(N[C@H]2C[C@@H](C)N(C3CC3)C2)c1[N+](=O)[O-] 133552392 FGDPXEMIHPAZRY-MNOVXSKESA-N 276.340 2.335 5 50 CEBA O=[N+]([O-])c1cccnc1N1CCC(c2ncco2)CC1 585092335 QDKHDJVYDRARIK-UHFFFAOYSA-N 274.280 2.362 5 50 CEBA CN(C)[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)C12CCC2 585118033 VBEWEWPLHWPEJD-RYUDHWBXSA-N 276.340 2.275 5 50 CEBA C[C@H]1CN(c2cc([N+](=O)[O-])ccc2Cl)C[C@@H](C)N1 228933 HZFONUHGJQMUKR-DTORHVGOSA-N 269.732 2.435 5 50 CEBA CCCS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] 1443523 DQXLCPDWAPIHTC-UHFFFAOYSA-N 263.702 2.432 5 50 CEBA CC(C)CNc1cc(N2CCNCC2)ccc1[N+](=O)[O-] 4739214 ZHBXXBUUKIZRMS-UHFFFAOYSA-N 278.356 2.072 5 50 CEBA Cc1nn([C@@H](C)c2nnc3n2CCCCC3)cc1[N+](=O)[O-] 72334165 DOXJGTDWCFOOQX-JTQLQIEISA-N 290.327 2.027 5 50 CEBA CCC(CC)NCCNc1ncccc1[N+](=O)[O-] 585092378 TXSILDDUOJVLGE-UHFFFAOYSA-N 252.318 2.180 5 50 CEBA O=C(COc1ccccc1[N+](=O)[O-])Nc1cccnc1 238101 LMIHHPNSSJCMDI-UHFFFAOYSA-N 273.248 2.007 5 50 CEBA COc1ccc(C(=O)Nc2cc(C)on2)cc1[N+](=O)[O-] 175652 DVCPKXQZLIOBCG-UHFFFAOYSA-N 277.236 2.152 5 50 CEBA CC1=CC[C@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2C1 100499290 QVYQESJGNYAWIR-CHWSQXEVSA-N 286.287 2.441 5 50 CEBA O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCOCC1 4583051 OWEVRBSGOOUEDB-UHFFFAOYSA-N 285.687 2.112 5 50 CEBA CCOCCCNC(=O)c1cc([N+](=O)[O-])ccc1Cl 2735162 ZHPLPCZMACVTDD-UHFFFAOYSA-N 286.715 2.405 5 50 CEBA CC1(C)C[C@](Br)([N+](=O)[O-])C(C)(C)O1 958528129 JVNBCTMCZIUKHP-QMMMGPOBSA-N 252.108 2.332 5 50 CEBA NC(=O)c1ccc(Oc2ccccc2[N+](=O)[O-])cc1 7980664 ZKZULVSEXRNJRL-UHFFFAOYSA-N 258.233 2.486 5 50 CEBA CCCC(=O)NC(=S)Nc1cccc([N+](=O)[O-])c1 456231 JAFPFLJPYBGTTK-UHFFFAOYSA-N 267.310 2.208 5 50 CEBA O=[N+]([O-])c1ccc(I)c([N+](=O)[O-])c1 1706153 FXMKXMJLXRTQSW-UHFFFAOYSA-N 294.004 2.108 5 50 CEBA in-vitro CCOc1cc([N+](=O)[O-])c(OCC)cc1N1CCOCC1 4272132 KNHGNICBXADRMC-UHFFFAOYSA-N 296.323 2.229 5 50 CEBA CCCOc1ccc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 2479079 KVLKACSEXGPRLX-GXTWGEPZSA-N 278.308 2.072 5 50 CEBA Cc1cc(N2C(=O)c3ccccc3C2=O)ncc1[N+](=O)[O-] 45067998 AROADWGLGKWKQU-UHFFFAOYSA-N 283.243 2.099 5 50 CEBA COc1cccc([C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1 241447024 NQOKHSDOPDHZRO-HZSPNIEDSA-N 290.319 2.024 5 50 CEBA C[C@H]1CN(/C=C/[N+](=O)[O-])C[C@@H](C)N1C(=O)OC(C)(C)C 1535645762 VZFBVVGLBSJICB-XIUUEPKSSA-N 285.344 2.064 5 50 CEBA CCN(CC)C(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 316963 BFRHOYVTYIAVTM-UHFFFAOYSA-N 290.275 2.183 5 50 CEBA COC(=O)c1cccc([N+](=O)[O-])c1Br 1433281 YUWPKYJCYRFBJT-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA O=c1[nH]c(-c2ccc([N+](=O)[O-])cc2)nc2ccccc12 8911509 PDSXUXCWTDUVSZ-UHFFFAOYSA-N 267.244 2.498 5 50 CEBA CC(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1 219955 FXSSSPHKIZWHKQ-UHFFFAOYSA-N 289.247 2.399 5 50 CEBA CCn1cc(Cn2cc(Cl)c([N+](=O)[O-])n2)c(C)n1 2741231 BSPUZWABHIGJEW-UHFFFAOYSA-N 269.692 2.018 5 50 CEBA CCOc1ncc(Br)c(C)c1[N+](=O)[O-] 65337465 IVUKVYJBQLXLKD-UHFFFAOYSA-N 261.075 2.459 5 50 CEBA in-vitro CC[C@H](C)N(CCO)Cc1ccc(C)c([N+](=O)[O-])c1 585117241 VZNXBCJQOXXJNM-LBPRGKRZSA-N 266.341 2.496 5 50 CEBA Cc1cccc(NC(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)c1 1424780 LUBGMAHTIRHXOC-SNVBAGLBSA-N 274.280 2.299 5 50 CEBA O=[N+]([O-])c1ccc(CN2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)c(F)c1 408143795 CHROCPDJEWRXTD-DDHJSBNISA-N 292.310 2.343 5 50 CEBA C[C@H](C(=O)NCc1ccccn1)c1ccc([N+](=O)[O-])cc1 471495 CPHHPBKPPFTMGG-NSHDSACASA-N 285.303 2.410 5 50 CEBA COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCCC1 176390 SIYMLVHTBFAZEH-UHFFFAOYSA-N 293.323 2.028 5 50 CEBA COc1ccc([C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)cc1 248263502 WZZCIDDVFWYTFY-MGPQQGTHSA-N 292.335 2.174 5 50 CEBA CCN1C(=O)S/C(=C/c2cc([N+](=O)[O-])ccc2O)C1=O 13546724 PRWPFGVTIVBEFN-UXBLZVDNSA-N 294.288 2.357 5 50 CEBA O=[N+]([O-])c1ccc(Cl)cc1CN1CCOCC1 19634513 NOYOFRMLCQBGPG-UHFFFAOYSA-N 256.689 2.080 5 50 CEBA CCOC(=O)C(=Cc1ccccc1[N+](=O)[O-])C(=O)OCC 1641612 BLHLIGAACQEKRY-UHFFFAOYSA-N 293.275 2.104 5 50 CEBA in-vitro CC(=O)OC1(C[N+](=O)[O-])C2CC3CC(C2)CC1C3 272807 NMUOZYVPRDJNNV-UHFFFAOYSA-N 253.298 2.021 5 50 CEBA COc1ccc(NC(=O)c2cccnc2)c([N+](=O)[O-])c1 4257580 ZHNVFWWIXPGJQY-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA O=[N+]([O-])c1cccc(Oc2nnnn2-c2ccccc2)c1 4622946 QZJTYTSDSLYLIN-UHFFFAOYSA-N 283.247 2.363 5 50 CEBA Cc1nn(-c2cccc(C(=O)O)c2)c(C)c1[N+](=O)[O-] 4385405 QVOJDHFRGANLGJ-UHFFFAOYSA-N 261.237 2.096 5 50 CEBA O=[N+]([O-])c1cccc(C2N(O)[C@H]3CCCC[C@@H]3N2O)c1 5005513 PTWXTNYVTQSTRA-RYUDHWBXSA-N 279.296 2.301 5 50 CEBA CC(C)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 4170531 YMVRNKOYZPEJAJ-UHFFFAOYSA-N 263.341 2.121 5 50 CEBA CCC[C@H](C)NC(=O)Cc1ccccc1[N+](=O)[O-] 442469 OJHACMXUDLSPDQ-JTQLQIEISA-N 250.298 2.442 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCCO 4719244 LVDMYTHNPRJUFI-UHFFFAOYSA-N 264.203 2.408 5 50 CEBA CC(C)(C)C(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1 4821017 AVELMUARCLUJGO-UHFFFAOYSA-N 281.337 2.454 5 50 CEBA Cc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2)s1 16996551 UHWVXZUPIKULKG-UHFFFAOYSA-N 264.266 2.007 5 50 CEBA C[C@H]1C[C@H](C)CN(c2ccc([N+](=O)[O-])c(N)n2)C1 167783302 AIRBASRMKCIKSZ-IUCAKERBSA-N 250.302 2.054 5 50 CEBA Cc1ccc(C(=O)N2C[C@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] 183297 LIYWCRBOFGSVOU-PHIMTYICSA-N 278.308 2.153 5 50 CEBA CC(C)CC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1 4091645 MOTHKGOUTIAOGM-UHFFFAOYSA-N 281.337 2.454 5 50 CEBA O=C(O)CNc1cc(C(F)(F)F)ccc1[N+](=O)[O-] 216699477 FLJQZHNYJYSJPI-UHFFFAOYSA-N 264.159 2.110 5 50 CEBA CC(C)[C@H](C)N(C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 222082513 GLSDCQNTGZTMKJ-GXTWGEPZSA-N 296.367 2.311 5 50 CEBA O=C(NC(=S)N1CCCCC1)c1ccc([N+](=O)[O-])cc1 238014 NNLXQFYRRIOBRK-UHFFFAOYSA-N 293.348 2.095 5 50 CEBA O=[N+]([O-])c1ccc(SCCO)c2ncccc12 1843914 ICJBWBHLZDQWFT-UHFFFAOYSA-N 250.279 2.227 5 50 CEBA O=[N+]([O-])C[C@@H](c1ccccc1)S(=O)(=O)c1ccccc1 3069744 XMKJTJSZFKWLAH-AWEZNQCLSA-N 291.328 2.478 5 50 CEBA O=[N+]([O-])c1ccccc1CN1CCN(c2ccccn2)CC1 4978363 ULYPKTSOBGREPB-UHFFFAOYSA-N 298.346 2.312 5 50 CEBA Cc1c(Cl)c([N+](=O)[O-])nn1Cc1ccc(C(=O)O)o1 550135 SJJKQMUBDLEUNP-UHFFFAOYSA-N 285.643 2.093 5 50 CEBA Cc1cccc(NC(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)c1 1424781 LUBGMAHTIRHXOC-JTQLQIEISA-N 274.280 2.299 5 50 CEBA O=Cc1ccc(Sc2ncccn2)c([N+](=O)[O-])c1 470422 ZCCDTCNRWIVGKG-UHFFFAOYSA-N 261.262 2.349 5 50 CEBA O=[N+]([O-])c1cccc(F)c1N[C@H]1CC[C@H](O)CC1 242463840 DOCJRGFQFWNBLW-KYZUINATSA-N 254.261 2.449 5 50 CEBA O=[N+]([O-])c1cnc(N2CCCC2)c(Br)c1 38537094 YZDNWQJSPBAYQY-UHFFFAOYSA-N 272.102 2.353 5 50 CEBA in-vitro CCCOc1ccc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 2479084 KVLKACSEXGPRLX-TZMCWYRMSA-N 278.308 2.072 5 50 CEBA Cc1ccnc(N2CCC[C@]3(CCN(C)C3)C2)c1[N+](=O)[O-] 585092037 BXMQWANTOFEKCO-OAHLLOKOSA-N 290.367 2.220 5 50 CEBA Cc1ccnc(NCC2([S@@](C)=O)CCC2)c1[N+](=O)[O-] 280714133 IAWAXWYTBYYBIS-LJQANCHMSA-N 283.353 2.011 5 50 CEBA COCCCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 2766020 MRVFIWBRQVPUIQ-UHFFFAOYSA-N 272.688 2.015 5 50 CEBA O=[N+]([O-])c1cc(Br)cnc1N1CCCC1 38536971 YGKJRFMYKUCINF-UHFFFAOYSA-N 272.102 2.353 5 50 CEBA O=[N+]([O-])c1cccnc1N1CCCC[C@H]1c1cc[nH]n1 240707794 HQOZWNVRRDNHGI-NSHDSACASA-N 273.296 2.445 5 50 CEBA CCc1n[nH]c(SCC(=O)c2cccc([N+](=O)[O-])c2)n1 18276882 HZTSTDCCDVMERB-UHFFFAOYSA-N 292.320 2.250 5 50 CEBA O=C(NCc1ccccn1)Nc1ccc([N+](=O)[O-])cc1 4983094 GSRYGIGSFLKHJA-UHFFFAOYSA-N 272.264 2.312 5 50 CEBA O=c1c2ccccc2ncn1Cc1ccccc1[N+](=O)[O-] 1677615 ZKCLILYELAGDHJ-UHFFFAOYSA-N 281.271 2.353 5 50 CEBA CC(=O)c1ccc[n+](Cc2ccc([N+](=O)[O-])cc2)c1 1744530 IOHVLCYSWMQEIG-UHFFFAOYSA-N 257.269 2.133 5 50 CEBA O=C(NCc1ccco1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2901686 QMHULBKTESOPSA-UHFFFAOYSA-N 291.219 2.026 5 50 CEBA C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)C[C@@H](C2CC2)O1 408521035 GBFFIWCBVMDXBT-PELKAZGASA-N 281.287 2.133 5 50 CEBA Cc1cccc[n+]1-c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5711500 DJQHHKOJKHGSIV-UHFFFAOYSA-N 260.229 2.088 5 50 CEBA O=C1N[C@@H](c2cccc([N+](=O)[O-])c2)Oc2ccccc21 344924 XCTIHFILMXCQSS-CQSZACIVSA-N 270.244 2.416 5 50 CEBA O=[N+]([O-])c1ccc(N[C@@H]2CCN3CCCC[C@@H]23)nc1 222684543 XJAZPHSIBCIAOZ-NEPJUHHUSA-N 262.313 2.029 5 50 CEBA O=C(NCCN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 4777399 QYQSOSZWSYYJGU-UHFFFAOYSA-N 292.339 2.202 5 50 CEBA O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2C[C@H]3CC[C@H]2C3)c1 101479141 UXQHTIJOCUWHAR-KWBADKCTSA-N 296.348 2.062 5 50 CEBA O=C(NC1CC1)c1ccc(Br)c([N+](=O)[O-])c1 8034844 MLKWFRMOGRIXEW-UHFFFAOYSA-N 285.097 2.250 5 50 CEBA in-vitro O=[N+]([O-])c1ccc(OCCCCCN2CCOCC2)cc1 19607600 QTKPBWWPUDOQGJ-UHFFFAOYSA-N 294.351 2.476 5 50 CEBA COc1ccc(Nc2ncnc(N)c2[N+](=O)[O-])cc1Cl 3912588 VNIVRTVVDOEJDT-UHFFFAOYSA-N 295.686 2.373 5 50 CEBA O=C(COC(=O)c1cccnc1)c1ccc([N+](=O)[O-])cc1 285466 XNJVUBRTBRJKIF-UHFFFAOYSA-N 286.243 2.030 5 50 CEBA Cc1ccc([C@@H](C)NC(=O)c2c([N+](=O)[O-])cnn2C)cc1 2764526 XWPKRGSNKNBFCQ-SNVBAGLBSA-N 288.307 2.128 5 50 CEBA Cn1cnnc1[C@@H]1CCCN1c1cccc(F)c1[N+](=O)[O-] 271011479 DHJQXNVZANCTCO-NSHDSACASA-N 291.286 2.204 5 50 CEBA CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCCOCC1 192744850 JBPURSQCGIDVFQ-JTQLQIEISA-N 268.317 2.101 5 50 CEBA Cc1ccnc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 306791 SVWOFYPUPYFKMM-UHFFFAOYSA-N 287.275 2.316 5 50 CEBA O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCCCC1 3156786 OLDIZVYVZUAMIZ-UHFFFAOYSA-N 279.252 2.129 5 50 CEBA CC(C)(C)OC(=O)NCc1ccc([N+](=O)[O-])cn1 59241269 PZFFLSWUBIVDJT-UHFFFAOYSA-N 253.258 2.015 5 50 CEBA CC[C@@H]1CN(c2ncccc2[N+](=O)[O-])[C@H](CC)CO1 585090430 MVDDTETXMGOLIJ-GHMZBOCLSA-N 265.313 2.384 5 50 CEBA CCOC(=O)c1sc(N)nc1-c1ccc([N+](=O)[O-])cc1 124419 XQZQJOZWHWHSDG-UHFFFAOYSA-N 293.304 2.477 5 50 CEBA Cc1occc1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 195060569 WRSLEHVWCBRBED-UHFFFAOYSA-N 281.289 2.470 5 50 CEBA CS[C@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@@H]1N(C)C 270667531 QLGJJNHTKZGXQJ-KBPBESRZSA-N 295.408 2.072 5 50 CEBA Cc1ccc(OCCN2C[C@H](C)O[C@H](C)C2)c([N+](=O)[O-])c1 20167796 LPQPPEMRNGDHPA-BETUJISGSA-N 294.351 2.391 5 50 CEBA Cc1nc2oc3ccccc3c(=O)c2cc1C(=O)O 1387334 PFPUNTDSZCGFPG-UHFFFAOYSA-N 255.229 2.348 5 50 CEBA C[C@H]1CN(CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 13153568 FCYJLRKXYVYLEN-TXEJJXNPSA-N 280.324 2.083 5 50 CEBA Cc1cc(NC(=O)NCCCF)ccc1[N+](=O)[O-] 153828609 AHAKVMRUXHFALJ-UHFFFAOYSA-N 255.249 2.384 5 50 CEBA CCc1[nH]nc(NC(=O)c2ccc([N+](=O)[O-])cc2O)c1C 163366098 GWDGIUWNSUJFAE-UHFFFAOYSA-N 290.279 2.147 5 50 CEBA C[Si](C)(C)[C@@]12[C@H]3[C@@H]4[C@@H]5C[C@H]3[C@@]36O[C@]53[C@H](C[C@@H]61)[C@@]42[N+](=O)[O-] 257356448 ICEFMYGKFMZPDE-DDSRMYRNSA-N 289.407 2.147 5 50 CEBA O=[N+]([O-])c1ccc(-c2csc(N3CCNCC3)n2)cc1 4783916 ZZKZGNQWPHPUMG-UHFFFAOYSA-N 290.348 2.128 5 50 CEBA CCC(=O)c1ccc(N2C[C@@H](C)[C@@H](CN)C2)c([N+](=O)[O-])c1 864586803 XUIQKUJUKXWJKH-PWSUYJOCSA-N 291.351 2.219 5 50 CEBA O=[N+]([O-])c1cnc2c(F)cc(Br)cn12 1775955652 OICHHGVQEWCFTA-UHFFFAOYSA-N 260.022 2.144 5 50 CEBA CC(=O)Oc1ccc2nc3ccc(=O)cc-3oc2c1 4521821 UJWKHDKBOVPINX-UHFFFAOYSA-N 255.229 2.218 5 50 CEBA in-vitro C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccn1 4750389 GUMANOPUSDMQEA-JTQLQIEISA-N 287.275 2.396 5 50 CEBA O=[N+]([O-])c1cccnc1N1CCN[C@H](Cc2ccccc2)C1 1145117663 FBRQLKGRGBEBNF-CQSZACIVSA-N 298.346 2.011 5 50 CEBA CCCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C 3106220 RPNQPFJFCUXTKB-UHFFFAOYSA-N 281.268 2.341 5 50 CEBA O=C(COc1ccc([N+](=O)[O-])cc1)c1ccc(O)cc1O 459126 LXRDYFUDWUKCMP-UHFFFAOYSA-N 289.243 2.268 5 50 CEBA O=C1N[C@H](c2ccccc2[N+](=O)[O-])Oc2ccccc21 4783735 TVZXSLSWFREWHN-AWEZNQCLSA-N 270.244 2.416 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)c2ccco2)cc1 6322490 LAOFLSNEBKSTIV-UHFFFAOYSA-N 253.235 2.021 5 50 CEBA CCOC(=O)C1CCN(Cc2ccccc2[N+](=O)[O-])CC1 55543394 MOQUVEKLTZGVSO-UHFFFAOYSA-N 292.335 2.370 5 50 CEBA C[C@@H]1c2ccccc2OCCN1c1ncc([N+](=O)[O-])cn1 584908571 RYYCVYNRYNYNSE-SNVBAGLBSA-N 286.291 2.345 5 50 CEBA Cc1ccc(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)o1 166177926 LIJZMUSSBAITNY-UHFFFAOYSA-N 262.221 2.454 5 50 CEBA NC(=O)N1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 301426388 HPBIDCODCCEPMW-MRVPVSSYSA-N 298.730 2.203 5 50 CEBA CCn1ncc(CNC(=O)c2cccc([N+](=O)[O-])c2)c1C 473354 LMIOMFWJIOQBOQ-UHFFFAOYSA-N 288.307 2.050 5 50 CEBA O=[N+]([O-])c1ccc(N2CC[C@@](F)(CO)C2)c2ccncc12 253392805 GMOVHVQRNYOXOD-AWEZNQCLSA-N 291.282 2.054 5 50 CEBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@H]2OCCC[C@H]12 192621562 AZIFUXWYXGWMCM-NQBHXWOUSA-N 290.319 2.201 5 50 CEBA CC1(C)C[C@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)C(=O)O1 171083 YYEKUCDAPYUORF-VIFPVBQESA-N 292.291 2.265 5 50 CEBA Cc1ccc(NC(=O)[C@@H]2CCCO2)cc1[N+](=O)[O-] 474760 UPFPUBPSJQCXFH-NSHDSACASA-N 250.254 2.021 5 50 CEBA COc1ccc([N+](=O)[O-])c(N2CCC(OC)CC2)c1 266133747 DPQNZPVIBAYMBA-UHFFFAOYSA-N 266.297 2.219 5 50 CEBA Cc1cc(N2CCn3nccc3C2)ccc1[N+](=O)[O-] 585122538 WVSAECGGYQWCEJ-UHFFFAOYSA-N 258.281 2.120 5 50 CEBA Cc1nnc(NC(=O)c2cccc(C)c2[N+](=O)[O-])s1 463544 OCXUCVOWSCYDTI-UHFFFAOYSA-N 278.293 2.315 5 50 CEBA Cc1cc(OCC(=O)Nc2cccnc2)ccc1[N+](=O)[O-] 620508 ATZHDQIDGPRPAY-UHFFFAOYSA-N 287.275 2.316 5 50 CEBA COc1ccc(NCn2nnc3ccccc32)c([N+](=O)[O-])c1 3953443 ZZPZKVKWWIWJDN-UHFFFAOYSA-N 299.290 2.418 5 50 CEBA Cc1cc(C)n2nc(NCc3cccc([N+](=O)[O-])c3)nc2n1 1078114 ASPMOCDCBQAMSL-UHFFFAOYSA-N 298.306 2.261 5 50 CEBA CN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])o1 2479025 KRBCCPLCOYOYAP-UHFFFAOYSA-N 260.249 2.460 5 50 CEBA CS(=O)(=O)Oc1ccc2c(c1)oc(=O)c1ccccc12 2996505 QDPLDLVNDNLCPL-UHFFFAOYSA-N 290.296 2.285 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1SC[C@@H](O)CO 615893 ZVKVWGOPTNTEKZ-ZETCQYMHSA-N 297.254 2.059 5 50 CEBA Cc1ccc([N+](=O)[O-])c(OCCN2C[C@@H](C)O[C@H](C)C2)c1 20652740 GSXTXISIEHKLME-CHWSQXEVSA-N 294.351 2.391 5 50 CEBA CCC(=O)Nc1cc(SCCO)cc([N+](=O)[O-])c1 2113190 RBJACNFURDNSJH-UHFFFAOYSA-N 270.310 2.028 5 50 CEBA O=C(O)c1cc(Br)cc([N+](=O)[O-])c1F 35333673 SXOKSXISBYNNQM-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA in-vitro CC(=O)Cn1nc([N+](=O)[O-])nc1Sc1ccc(C)cc1 466028 QKECKRGDAFTHPC-UHFFFAOYSA-N 292.320 2.235 5 50 CEBA Cc1ccc([N+](=O)[O-])c(OCCNC[C@@H]2CCCO2)c1 4842302 YOWGDBPIQIRHQF-LBPRGKRZSA-N 280.324 2.051 5 50 CEBA O=[N+]([O-])c1ccc(/C=C/c2nn3cnnc3s2)cc1 4839637 UPHKUBFULAWFLA-ZZXKWVIFSA-N 273.277 2.264 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H]3OCCC[C@H]23)c1 193524044 AWFYVODLDALFMD-GIPNMCIBSA-N 263.297 2.156 5 50 CEBA O=[N+]([O-])c1ccc(N2CCN(Cc3ccccn3)CC2)cc1 53215669 GCWYVKDZTWYBRI-UHFFFAOYSA-N 298.346 2.312 5 50 CEBA Cc1cc(C)nc(Nc2ccc([N+](=O)[O-])cc2O)n1 4528465 ULIGOOJEIQTURB-UHFFFAOYSA-N 260.253 2.451 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[C@@H]1C 123028788 CBZXGNGUWMHPPJ-OIBJUYFYSA-N 265.269 2.133 5 50 CEBA O=C(c1ccc(Cl)c([N+](=O)[O-])c1)n1cccn1 461665 UUUIFKSQHOIKQV-UHFFFAOYSA-N 251.629 2.133 5 50 CEBA CCCN(CCC)C[C@@H](O)COc1ccc([N+](=O)[O-])cc1 2988679 PMQMBNQVHUERAZ-CQSZACIVSA-N 296.367 2.457 5 50 CEBA C[C@@H]1C=CC[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]21 239173989 PBLZWGAYCWXFBV-ICCXJUOJSA-N 286.287 2.296 5 50 CEBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H]1C(F)F 864091483 XFMQCZRYOZMNKG-LDYMZIIASA-N 299.277 2.261 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)c2ccccc2)cc1 133179 OECHJYYZMSUILG-UHFFFAOYSA-N 263.274 2.428 5 50 CEBA in-vitro O=[N+]([O-])c1cnn(C[C@@H]2CCC[C@H](C(F)(F)F)O2)c1 901457227 VAPBQVOONCJUQP-DTWKUNHWSA-N 279.218 2.291 5 50 CEBA O=C(NCC1(C2CC2)CC1)c1ccc([N+](=O)[O-])cc1O 158271337 ADWXQDXZIRJPTB-UHFFFAOYSA-N 276.292 2.220 5 50 CEBA CC(=O)Nc1ccc([N+](=O)[O-])cc1Br 5226637 CVRYGNVWNQYYEC-UHFFFAOYSA-N 259.059 2.316 5 50 CEBA COC(=O)c1cc(Br)c(OC)c([N+](=O)[O-])c1 20227872 FTUNSACBIXMAPH-UHFFFAOYSA-N 290.069 2.153 5 50 CEBA in-vitro CCN(c1ccccc1)c1ncnc(N)c1[N+](=O)[O-] 3912736 KHHDGACPYOTJHX-UHFFFAOYSA-N 259.269 2.125 5 50 CEBA CCOC(=O)CSc1ccc(C(=O)OC)cc1[N+](=O)[O-] 259750 IVGHCWSWZXVJHM-UHFFFAOYSA-N 299.304 2.037 5 50 CEBA O=C(Nc1ccccc1CO)c1cccc([N+](=O)[O-])c1 455449 STMWDYVLIJPLDB-UHFFFAOYSA-N 272.260 2.339 5 50 CEBA O=C(O)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 89064395 FKODWVXNPSOFRQ-UHFFFAOYSA-N 250.235 2.417 5 50 CEBA Cc1nn([C@@H](C)C(=O)N2CCCC[C@H]2C)cc1[N+](=O)[O-] 2776907 SSSYHYXDYDYNKC-KOLCDFICSA-N 280.328 2.062 5 50 CEBA CN(CC1CCC1)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] 169983811 BEKPKSJAOOPWTL-UHFFFAOYSA-N 288.307 2.068 5 50 CEBA COC(=O)c1ccc([N+](=O)[O-])cc1Br 12471065 XYMZAFDNPJLOTP-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA in-vitro C[C@H]1CCCN(c2ccc3nonc3c2[N+](=O)[O-])C1 4010556 YXPABINOQSWFKV-QMMMGPOBSA-N 262.269 2.367 5 50 CEBA Nc1nc(NCc2ccc(F)cc2)ccc1[N+](=O)[O-] 22009501 ZVCIIRBNNSUNCH-UHFFFAOYSA-N 262.244 2.323 5 50 CEBA in-vitro CC1(C)C[C@@](Br)([N+](=O)[O-])C(C)(C)O1 958528120 JVNBCTMCZIUKHP-MRVPVSSYSA-N 252.108 2.332 5 50 CEBA COC(=O)c1sc2ccc([N+](=O)[O-])cc2c1N 4268583 WMZGLTDTPSMOMC-UHFFFAOYSA-N 252.251 2.178 5 50 CEBA in-vitro O=[N+]([O-])c1cccnc1N1CC[C@H](c2ccncc2)C1 585092092 DVLXTOCPJXRBQW-LBPRGKRZSA-N 270.292 2.379 5 50 CEBA Cc1cnc(OCOC(=O)C(C)(C)C)c([N+](=O)[O-])c1 170591384 QGBBLVNYYFGSOY-UHFFFAOYSA-N 268.269 2.224 5 50 CEBA Cc1ccc(NC(=O)Cn2nc([N+](=O)[O-])cc2C)cc1C 1428824 CIKTYTXZZBBARK-UHFFFAOYSA-N 288.307 2.355 5 50 CEBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cn2)n1 2762866 JCVOLLDXJLALIH-UHFFFAOYSA-N 295.686 2.112 5 50 CEBA NS(=O)(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1 272701 ZOZNRXSLSXLSAD-UHFFFAOYSA-N 294.288 2.035 5 50 CEBA C[C@@H]1CC[C@H](NCCn2cc([N+](=O)[O-])cn2)C[C@H]1C 253370001 KWQYXLYMDNCCQQ-UTUOFQBUSA-N 266.345 2.206 5 50 CEBA C[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 16662097 PDCWUKWDEMRFTJ-PHIMTYICSA-N 250.298 2.204 5 50 CEBA Cn1cc([N+](=O)[O-])c(CNc2ccc(F)cc2)n1 1875290320 RVPPFFWRDDOIEB-UHFFFAOYSA-N 250.233 2.080 5 50 CEBA CCCC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 4537317 YYJIZJTYDLHGDD-UHFFFAOYSA-N 251.238 2.349 5 50 CEBA O=[N+]([O-])c1ccc(/C=C2\[C@@H](O)C3CCN2CC3)cc1 4833280 KWXOJIBUTPSKRN-SSUFTNFISA-N 260.293 2.022 5 50 CEBA COc1cccc([C@@H]2CCCN2C(=O)[C@H]2C[C@H]2[N+](=O)[O-])c1 241447025 NQOKHSDOPDHZRO-MELADBBJSA-N 290.319 2.024 5 50 CEBA Cc1cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])no1 464163 ZCMRKSWARKIBIK-UHFFFAOYSA-N 261.237 2.452 5 50 CEBA Cc1cc(NC(=O)N2CC[C@H](N(C)C)C2)ccc1[N+](=O)[O-] 153647358 SMGOGXZHEUMFDA-LBPRGKRZSA-N 292.339 2.071 5 50 CEBA CN1CC[C@@H]2CCN(c3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1 192558650 XDJXMUCHBUTNLS-QMTHXVAHSA-N 279.315 2.264 5 50 CEBA Cn1ncc2cc(Br)cc([N+](=O)[O-])c21 95743167 MKYFJOZCRQIMLH-UHFFFAOYSA-N 256.059 2.244 5 50 CEBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@H]2OCCC[C@@H]12 253355438 AZIFUXWYXGWMCM-DMDPSCGWSA-N 290.319 2.201 5 50 CEBA O=C(COC(=O)c1ccncc1)c1ccc([N+](=O)[O-])cc1 285455 PLYVWPQINUEOOI-UHFFFAOYSA-N 286.243 2.030 5 50 CEBA C[C@@H]1CN(C(=S)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 616404 OTWDABUDFHHNRI-NXEZZACHSA-N 280.349 2.380 5 50 CEBA C[C@H](Oc1ccc([N+](=O)[O-])cc1)c1ccnc2ncnn12 1401862 DVNSAJAEKMUPSC-VIFPVBQESA-N 285.263 2.173 5 50 CEBA CCOCCCNC(=O)c1cccc([N+](=O)[O-])c1C 2805333 QWTXTTBBHUQVHT-UHFFFAOYSA-N 266.297 2.060 5 50 CEBA C[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)C[C@H]1N(C)C 242197041 XHGWMGDLWDOKIC-IUODEOHRSA-N 277.368 2.019 5 50 CEBA COc1cn(C)nc1[C@H](C)Nc1ccc([N+](=O)[O-])c(C)n1 952992539 HVJRIXOPGMTSSJ-VIFPVBQESA-N 291.311 2.213 5 50 CEBA Cc1c(C(=O)N2CCCCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3154501 NYUIMWZLXPIUTJ-UHFFFAOYSA-N 293.279 2.438 5 50 CEBA O=[N+]([O-])c1ccc(NCCNCc2ccco2)cc1 4842946 RBCSIDRVMWAZPT-UHFFFAOYSA-N 261.281 2.390 5 50 CEBA O=[N+]([O-])c1cnn(C[C@H]2CCC[C@H](C(F)(F)F)O2)c1 901457229 VAPBQVOONCJUQP-RKDXNWHRSA-N 279.218 2.291 5 50 CEBA O=[N+]([O-])C[C@H](c1ccccc1)S(=O)(=O)c1ccccc1 3069743 XMKJTJSZFKWLAH-CQSZACIVSA-N 291.328 2.478 5 50 CEBA CC[C@H]1CN(c2ncccc2[N+](=O)[O-])[C@H](CC)CO1 585090431 MVDDTETXMGOLIJ-MNOVXSKESA-N 265.313 2.384 5 50 CEBA Cc1nn([C@H](C)C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] 295432380 UYSUQXCRDRUTHS-JBLDHEPKSA-N 294.355 2.165 5 50 CEBA Cn1ncnc1Sc1c(F)cc([N+](=O)[O-])cc1F 302785584 MSWFOCNZVCWHFW-UHFFFAOYSA-N 272.236 2.153 5 50 CEBA O=C(O)[C@H]1CCCC[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1 4596890 OMUPALOXANKWJW-RYUDHWBXSA-N 292.291 2.424 5 50 CEBA C[C@H](C(=O)NCc1cccnc1)c1ccc([N+](=O)[O-])cc1 471271 ODCUAQZUJMVWDW-NSHDSACASA-N 285.303 2.410 5 50 CEBA O=[N+]([O-])c1ccc(NCCCn2cccn2)s1 169974407 AATBFYDGRTWZLI-UHFFFAOYSA-N 252.299 2.355 5 50 CEBA CCCCNc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 3877747 MYVYIRGJUFAFHV-UHFFFAOYSA-N 283.240 2.413 5 50 CEBA Cn1nc(-c2ccc([N+](=O)[O-])cc2)c(C=O)c1Cl 332233 QZVLBEHQWPNEKF-UHFFFAOYSA-N 265.656 2.461 5 50 CEBA Cc1nn(C[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1C 170608278 YHUSVNGNXWJGMB-AWEZNQCLSA-N 275.308 2.450 5 50 CEBA O=C1Nc2ccc([N+](=O)[O-])cc2C12SCCS2 5049596 CZXFHLSBHJOKNR-UHFFFAOYSA-N 268.319 2.180 5 50 CEBA Cn1cc(CNc2ccc(F)cc2)c([N+](=O)[O-])n1 1875358441 WHJGYWCNTFSNGY-UHFFFAOYSA-N 250.233 2.080 5 50 CEBA Cc1cnc([N+](=O)[O-])n1CCOC(=O)c1cccc(F)c1 1423832 NAKFKSNPTQEVCN-UHFFFAOYSA-N 293.254 2.096 5 50 CEBA CCc1ccccc1NC(=O)Cn1c([N+](=O)[O-])cnc1C 205437 LYMGHADEMRDFHF-UHFFFAOYSA-N 288.307 2.301 5 50 CEBA O=C(O)c1csc(Nc2ccc([N+](=O)[O-])cc2)n1 4244895 PGLWAUKTPVYTHD-UHFFFAOYSA-N 265.250 2.493 5 50 CEBA O=C1[C@@H]2CC=CC[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 100399483 NTINCPQSZRXXQY-VXGBXAGGSA-N 272.260 2.050 5 50 CEBA COC(=O)c1cc(Br)c(F)c([N+](=O)[O-])c1 95496050 JNVZMPJUTRQPPB-UHFFFAOYSA-N 278.033 2.283 5 50 CEBA COc1ccc(-c2ccc([N+](=O)[O-])nc2)cc1C=O 725242471 IQXGYOOFOFQQDA-UHFFFAOYSA-N 258.233 2.478 5 50 CEBA CSc1ccc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 103393 KGPRPRLZOPUBMT-JQWIXIFHSA-N 266.322 2.005 5 50 CEBA Cc1cc(N2CCN[C@@H](c3ccccc3)C2)ncc1[N+](=O)[O-] 952881302 GIYFKCZMQHFBQH-CQSZACIVSA-N 298.346 2.449 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(C)on1 4749850 OHLMYENZVFGHBD-UHFFFAOYSA-N 277.236 2.152 5 50 CEBA C[C@@H](O)CCN(C)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 139508068 CNUYOYROAIYGDE-MRVPVSSYSA-N 286.715 2.091 5 50 CEBA O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]2C=C[C@H]1C2 125874399 RQKXTMNEPKLLQR-GMXVVIOVSA-N 272.304 2.423 5 50 CEBA COCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 149489 SUWVSMMYVZSTQD-UHFFFAOYSA-N 293.304 2.303 5 50 CEBA O=[N+]([O-])c1cc(F)ccc1I 2526231 ANPFMDLUEWNKIM-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA in-vitro O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cccs2)cc1 475086 ILZYPANIMNJWGI-UHFFFAOYSA-N 298.345 2.135 5 50 CEBA O=[N+]([O-])c1cc(Br)cnc1NC1CC1 39325996 PGANNHCGNMGTFO-UHFFFAOYSA-N 258.075 2.327 5 50 CEBA in-vitro O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2cccc3ccccc23)N1 105430 VSTQRSGTVPVEOS-HIFRSBDPSA-N 270.288 2.436 5 50 CEBA CC(C)N(C(C)C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 301479 XIVKPBDGGQIFKE-UHFFFAOYSA-N 286.353 2.402 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1C[C@H]2CC[C@H]1C2 101445642 ANDBBOGXHAZHQE-GARJFASQSA-N 296.348 2.062 5 50 CEBA CNc1ccc(C(=O)Nc2nccs2)cc1[N+](=O)[O-] 4759708 HYTWBFKICXFNKU-UHFFFAOYSA-N 278.293 2.345 5 50 CEBA Cc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)no1 437203 RPRBMSJOGKMEFD-UHFFFAOYSA-N 261.237 2.072 5 50 CEBA O=[N+]([O-])c1ccc(Cl)cc1NCCCN1CCOCC1 20159068 FISTVZNJYFHDCC-UHFFFAOYSA-N 299.758 2.382 5 50 CEBA O=[N+]([O-])c1ccsc1N1CCC[C@@H](c2nnc(O)o2)C1 589597805 VDMWOPDUPWNRGW-SSDOTTSWSA-N 296.308 2.129 5 50 CEBA CC(=O)CC(C)(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 1513448 QIXMWBNPWYRYOY-UHFFFAOYSA-N 285.321 2.126 5 50 CEBA COC(=O)c1cc(F)c([N+](=O)[O-])c(Br)c1 95830519 VTKKLEVLDPUKPD-UHFFFAOYSA-N 278.033 2.283 5 50 CEBA in-vitro O=C(Nc1ccc(O)c([N+](=O)[O-])c1)[C@@H]1C[C@@H]1c1cccnc1 170599969 NIJCUOWZCXJWNH-VXGBXAGGSA-N 299.286 2.438 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N2CCO[C@H](c3ccco3)C2)c1 193472622 PBNKSVLMYBSNGR-AWEZNQCLSA-N 289.291 2.348 5 50 CEBA CCC1(CC)CNC(=O)[C@@H]1Nc1ccc([N+](=O)[O-])c(C)n1 928995612 DBLDTCZGZNCRTM-LBPRGKRZSA-N 292.339 2.015 5 50 CEBA O=[N+]([O-])c1ccc(N[C@H]2CCN3CCCC[C@@H]23)nc1 222684610 XJAZPHSIBCIAOZ-RYUDHWBXSA-N 262.313 2.029 5 50 CEBA CCCN(CCC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 102578 FHJOMNWSFGPGKH-UHFFFAOYSA-N 286.353 2.406 5 50 CEBA CC(C)CNC(=O)CCC(=O)Nc1cccc([N+](=O)[O-])c1 2856295 QDTAZNGCBYHPLH-UHFFFAOYSA-N 293.323 2.086 5 50 CEBA Cc1cc(N2CCN[C@H](c3ccccc3)C2)ncc1[N+](=O)[O-] 952881297 GIYFKCZMQHFBQH-AWEZNQCLSA-N 298.346 2.449 5 50 CEBA O=C(Nc1ccc(Cl)nn1)c1ccc([N+](=O)[O-])cc1 3604743 SJFKAZGPHJAMRP-UHFFFAOYSA-N 278.655 2.291 5 50 CEBA O=[N+]([O-])c1ccc(N2CCC[C@@H](O)C2)c2cccnc12 4132288 XBQLWNUMHOMSNL-SNVBAGLBSA-N 273.292 2.104 5 50 CEBA Nc1c(Cl)cc(I)cc1[N+](=O)[O-] 59407724 BHGBOSXOBVKKQJ-UHFFFAOYSA-N 298.467 2.435 5 50 CEBA O=[N+]([O-])c1cccc([S@](=O)CC[C@H]2CCCO2)c1 888097693 YWFUDSBHUMCPRG-ADLMAVQZSA-N 269.322 2.272 5 50 CEBA CC(=O)Nc1cc([N+](=O)[O-])ccc1N1C[C@H](C)O[C@H](C)C1 1776111365 QTTFJVXWGKLNSS-AOOOYVTPSA-N 293.323 2.167 5 50 CEBA CC1(C)CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 408160765 XLYYGLPQYJAHRJ-UHFFFAOYSA-N 264.281 2.173 5 50 CEBA C[C@@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 456768 PTSMTPGJTINRMS-BYAJROORSA-N 290.319 2.244 5 50 CEBA CC[C@H](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)O 4918847 GRWPYFLGAQXKGF-SECBINFHSA-N 280.280 2.424 5 50 CEBA Cn1nc(Br)c2cccc([N+](=O)[O-])c21 28540320 HQCVNVOZRXFKNJ-UHFFFAOYSA-N 256.059 2.244 5 50 CEBA C[C@H]1CN(CCOc2ccccc2[N+](=O)[O-])C[C@H](C)O1 20167788 FCYJLRKXYVYLEN-RYUDHWBXSA-N 280.324 2.083 5 50 CEBA Cc1cc(O)c(I)cc1[N+](=O)[O-] 675052024 SUBUJCUCAVAKTM-UHFFFAOYSA-N 279.033 2.213 5 50 CEBA COC(=O)c1cc(C)c(Br)c([N+](=O)[O-])c1 184587 SDGJHNRLPOEFDD-UHFFFAOYSA-N 274.070 2.452 5 50 CEBA Cn1ccnc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1 3899840 IHSHICXTXNRDNB-UHFFFAOYSA-N 292.320 2.059 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)Oc1ccccc1 1728594 PAWIDEIFQKJVBG-UHFFFAOYSA-N 279.273 2.363 5 50 CEBA CC(C)(C)C[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1[N+](=O)[O-] 252677910 AYMNEUZOXABTIE-GARJFASQSA-N 254.330 2.079 5 50 CEBA CCn1cc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cn1 1002227 KDNFJBMLXSNPTG-UHFFFAOYSA-N 274.280 2.372 5 50 CEBA Cc1c(Cl)c([N+](=O)[O-])nn1Cc1ccc(C(=O)O)cc1 368983 RPDSHNBIFOPINO-UHFFFAOYSA-N 295.682 2.500 5 50 CEBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)N1 3877878 UEIVDYVQWOFTJP-DTORHVGOSA-N 269.732 2.435 5 50 CEBA C[C@@H](Nc1ncc([N+](=O)[O-])s1)c1nnc2n1CCCC2 192493507 VZVAVDQZJIIFKU-SSDOTTSWSA-N 294.340 2.152 5 50 CEBA CC(C)(C)C(=O)NC(=S)Nc1cccc([N+](=O)[O-])c1 146196 GEMFPQYWEOGFPZ-UHFFFAOYSA-N 281.337 2.454 5 50 CEBA CC1=C[C@H]2C[C@H]1[C@@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]12 222269302 DGHBLVQCGKCDAG-VZLIPTOUSA-N 298.298 2.296 5 50 CEBA COC(=O)c1cc(OC)c(Br)cc1[N+](=O)[O-] 222000104 HBRVKIMKZSYQHS-UHFFFAOYSA-N 290.069 2.153 5 50 CEBA Nc1c(I)cc(Cl)cc1[N+](=O)[O-] 95630359 WDQPNLNIJFQQRL-UHFFFAOYSA-N 298.467 2.435 5 50 CEBA in-vitro CCOC(=O)COc1ccc(/C=C/[N+](=O)[O-])cc1OCC 474225 VHOZKXIKCKMTEX-BQYQJAHWSA-N 295.291 2.275 5 50 CEBA CCN(CC)C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 445327 PFKRYMJGLWGVNW-UHFFFAOYSA-N 282.296 2.094 5 50 CEBA Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC=CCC1 170593223 XQWFNOKMQZGMSF-VIFPVBQESA-N 261.281 2.016 5 50 CEBA Cc1cc(C(=O)OCCc2cnn(C)c2)ccc1[N+](=O)[O-] 114985379 DMYLHYXEENDNOE-UHFFFAOYSA-N 289.291 2.036 5 50 CEBA C[N+](C)(C)[C@@H]1[C@H]2CC[C@H]3C2C2[C@H]1CC[C@H]2[C@@H]3[N+](C)(C)C 257356190 GRVSLICFPDXWRA-BXSOIUCOSA-N 278.484 2.448 5 50 CEBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1cc(F)ccc1F 1070743 WSWHIBIEARAKSE-UHFFFAOYSA-N 296.233 2.017 5 50 CEBA COc1ccc(N2C(=O)CCC([N+](=O)[O-])=C2C)cc1 448173 RTOFGGBCQPCAAP-UHFFFAOYSA-N 262.265 2.330 5 50 CEBA Cc1nccc([N+](=O)[O-])c1CS(=O)(=O)c1ccccc1 530655 GQMFCXJAWFZKHY-UHFFFAOYSA-N 292.316 2.272 5 50 CEBA CN1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 4004809 NADZMUZERVWRKC-UHFFFAOYSA-N 289.257 2.365 5 50 CEBA Cc1ccc(-n2nnc([N+](=O)[O-])c2C)cc1Cl 1383824 DOIAYCADGOENGB-UHFFFAOYSA-N 252.661 2.446 5 50 CEBA Cc1nn([C@@H](C)C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] 295432386 UYSUQXCRDRUTHS-UMNHJUIQSA-N 294.355 2.165 5 50 CEBA COc1cc2c(O)c([N+](=O)[O-])c(C)nc2cc1[N+](=O)[O-] 16249274 QOGXKKAFGIFDFX-UHFFFAOYSA-N 279.208 2.074 5 50 CEBA COc1cc(Br)c([N+](=O)[O-])cc1OC 39672 DGUDEQARXVYDBS-UHFFFAOYSA-N 262.059 2.375 5 50 CEBA CC(=O)c1c(C)nc(-c2cccc([N+](=O)[O-])c2)n1O 1056819 ORLVPGRNEYDRAJ-UHFFFAOYSA-N 261.237 2.207 5 50 CEBA O=C(NCc1cccnc1)Nc1ccc([N+](=O)[O-])cc1 5224211 CLKZWXHKFXZIMA-UHFFFAOYSA-N 272.264 2.312 5 50 CEBA O=[N+]([O-])c1cnccc1Nc1cccc(C2=NCCN2)c1 4187634 AAWOAGQVCBMBKO-UHFFFAOYSA-N 283.291 2.083 5 50 CEBA Cc1c(Br)cc(C(=O)O)cc1[N+](=O)[O-] 2576238 JEOLKHVBUQVYCK-UHFFFAOYSA-N 260.043 2.364 5 50 CEBA CC1=CC[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]2C1 100009996 XSFLPRLCSDPYRO-STQMWFEESA-N 286.287 2.441 5 50 CEBA Cn1c(CN2CCCCC2)nc2cc([N+](=O)[O-])ccc21 4628465 NQSUEDUEGDWMNA-UHFFFAOYSA-N 274.324 2.467 5 50 CEBA COCCn1c(=O)c2ccccc2c2ccccc2c1=O 2455873 YXMGBEAKUNTQFW-UHFFFAOYSA-N 281.311 2.161 5 50 CEBA CC1=CC[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]2C1 100009989 XSFLPRLCSDPYRO-QWHCGFSZSA-N 286.287 2.441 5 50 CEBA O=C1N[C@@H](c2ccccc2[N+](=O)[O-])Oc2ccccc21 4783734 TVZXSLSWFREWHN-CQSZACIVSA-N 270.244 2.416 5 50 CEBA COC(=O)c1c([N+](=O)[O-])ccc(N(C)OC)c1Cl 408524746 YPSHAPRDHCPQRH-UHFFFAOYSA-N 274.660 2.032 5 50 CEBA O=[N+]([O-])c1cccc(Cl)c1NCCCN1CCOCC1 19792499 JYQNCRFMAZJKSP-UHFFFAOYSA-N 299.758 2.382 5 50 CEBA COc1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1OC 1059574 ODQCPADSBRQTKN-UHFFFAOYSA-N 291.307 2.474 5 50 CEBA CCC(C)(C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 2847117 YKTXFXCDFJIXTN-UHFFFAOYSA-N 272.326 2.062 5 50 CEBA O=[N+]([O-])c1cc(Cl)cnc1NCCCc1ncc[nH]1 139991252 FDMUOZMHHUKCFE-UHFFFAOYSA-N 281.703 2.411 5 50 CEBA CCN1C(=O)c2cccc3c([N+](=O)[O-])ccc(c23)C1=O 4142325 AXTWENNNDXTGTC-UHFFFAOYSA-N 270.244 2.364 5 50 CEBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1c(C)noc1C 4749936 LIEJEMJQQATZDO-UHFFFAOYSA-N 291.263 2.461 5 50 CEBA CS[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@H]1N(C)C 270667534 QLGJJNHTKZGXQJ-ZIAGYGMSSA-N 295.408 2.072 5 50 CEBA O=[N+]([O-])c1cc(Cl)c(OP(=O)(O)O)c(Cl)c1 2508187 OBFPUWKJCNIVNM-UHFFFAOYSA-N 287.979 2.373 5 50 CEBA C[N@@+]12CCC[C@H]3[C@H]4CCCC(=O)N4C[C@@H](CCC1)[C@H]32 239274889 AVTHDTNSRLXBOV-HUIPPAIASA-N 263.405 2.016 5 50 CEBA biogenic C[C@H](NC[C@H](C)[S@](C)=O)c1ccc([N+](=O)[O-])cc1 211268800 LXUBMYSFGRTNKQ-RAALSFIWSA-N 270.354 2.012 5 50 CEBA CC1(C)C[N+]2(CCS(=O)(=O)CC2)C[C@@H]1c1ccccc1 1615056195 HZLWZYBYIJGRKQ-OAHLLOKOSA-N 294.440 2.055 5 50 CEBA CN1CCC(N(C)Cc2ccc([N+](=O)[O-])cc2)CC1 240347 IOGOFXGQQRHSIE-UHFFFAOYSA-N 263.341 2.121 5 50 CEBA O=C(O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 3886314 BJFMTEPHRNENIO-UHFFFAOYSA-N 250.254 2.283 5 50 CEBA O=[N+]([O-])c1ccc(N2CCOCC2)c(Br)c1 4014148 FDGXBSITNUOBQT-UHFFFAOYSA-N 287.113 2.194 5 50 CEBA CCN(CC)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 3877750 HGZRREOJHASMOE-UHFFFAOYSA-N 282.300 2.257 5 50 CEBA in-vitro O=C(CC(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cn1 5158633 NBXHVVQGHADIGN-UHFFFAOYSA-N 285.259 2.201 5 50 CEBA O=C(NCc1cccnc1)Nc1cccc([N+](=O)[O-])c1 12595994 LVNFPIBESKXRSY-UHFFFAOYSA-N 272.264 2.312 5 50 CEBA C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 19607083 GGHVLSZFXJPAPS-GHMZBOCLSA-N 250.298 2.204 5 50 CEBA O=C(Cn1cnc([N+](=O)[O-])c1)Nc1ccc(F)c(Cl)c1 823952 NKXDVOWZLHKTLM-UHFFFAOYSA-N 298.661 2.223 5 50 CEBA O=[N+]([O-])c1cccc(OCCN2CCCCC2)c1 4841629 CZAMFZHFKJGTRV-UHFFFAOYSA-N 250.298 2.460 5 50 CEBA CCc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1 4854690 IJBKPRLIGSWISH-BQYQJAHWSA-N 287.275 2.117 5 50 CEBA Cc1n[nH]c(SCc2ccc(O)c([N+](=O)[O-])c2)n1 36033867 OMSYDOJMZBNOQZ-UHFFFAOYSA-N 266.282 2.019 5 50 CEBA O=C(c1cccc([N+](=O)[O-])c1)n1cc(Br)cn1 191571 OMTPLQRCGFZZNP-UHFFFAOYSA-N 296.080 2.242 5 50 CEBA O=[N+]([O-])c1ccc(N2CCC[C@@H](c3cnn[nH]3)C2)c(F)c1 1775985685 QRSLSGVZPKHYTQ-SECBINFHSA-N 291.286 2.236 5 50 CEBA O=C(O)/C=C/c1ccc(Br)cc1[N+](=O)[O-] 39953685 KPPLDWZFIDADCX-DUXPYHPUSA-N 272.054 2.455 5 50 CEBA in-vitro CC(C)(C)OC(=O)N1CCC(n2cc([N+](=O)[O-])cn2)CC1 74938170 JKRMWACLUFEWPC-UHFFFAOYSA-N 296.327 2.363 5 50 CEBA in-vitro CCN(CC)c1c([N+](=O)[O-])c(=O)n(C)c2ccccc12 4256011 FPNBOZWNRHNYTA-UHFFFAOYSA-N 275.308 2.293 5 50 CEBA Cc1cccc(C(=O)n2nc(C)c([N+](=O)[O-])c2C)c1 483658 AWKMSMVUMJQGPO-UHFFFAOYSA-N 259.265 2.405 5 50 CEBA CC[N@+]12CCC[C@@H]3CN4C(=O)CCC[C@H]4[C@@H](CCC1)[C@H]32 252441086 FFXCRHHKJZTONF-JBFGMIDGSA-N 277.432 2.406 5 50 CEBA biogenic CCCCONC(=O)Nc1ccc([N+](=O)[O-])cc1 5466052 BHCKLXGZNBUNKO-UHFFFAOYSA-N 253.258 2.448 5 50 CEBA COC[C@H](C)NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 456802 LGSSWAVKQJFAOY-ZETCQYMHSA-N 272.688 2.013 5 50 CEBA O=[N+]([O-])c1ccc(CN2CCCC[C@H]2CCO)cc1 4947938 CITTVJTYGPEOFC-ZDUSSCGKSA-N 264.325 2.332 5 50 CEBA O=[N+]([O-])c1ccc(N2CC[C@H](c3cc[nH]n3)C2)c(F)c1 1775985656 JRHDQOMAVVRUQS-VIFPVBQESA-N 276.271 2.451 5 50 CEBA Cc1cn(CC(=O)Nc2cccc(Cl)c2)nc1[N+](=O)[O-] 170619696 NVQRGUDLACHWLY-UHFFFAOYSA-N 294.698 2.392 5 50 CEBA CCc1c(Cl)nc2c([N+](=O)[O-])ccc(C)n2c1=O 725245542 VKUADNJWYAMIIP-UHFFFAOYSA-N 267.672 2.127 5 50 CEBA COc1ccc(-n2c(C)cc(=O)cc2C)c([N+](=O)[O-])c1 86356 GLVDITZFVHGBDX-UHFFFAOYSA-N 274.276 2.371 5 50 CEBA CC1=C[C@H]2C[C@H]1[C@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]21 100902174 DGHBLVQCGKCDAG-KQURDKLPSA-N 298.298 2.296 5 50 CEBA O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2)c1 20522715 MBUHSMPFSBDIBR-OAHLLOKOSA-N 272.304 2.418 5 50 CEBA CCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 16125181 FHEIOBOAFHYCRB-UHFFFAOYSA-N 287.113 2.497 5 50 CEBA CCCCN(CC)S(=O)(=O)c1ccccc1[N+](=O)[O-] 2739436 HCRRIPHNLYGMOH-UHFFFAOYSA-N 286.353 2.406 5 50 CEBA N=C(O)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 82138904 FQURMLNTZHENFB-UHFFFAOYSA-N 263.297 2.342 5 50 CEBA CCCS(=O)(=O)Nc1cc(C)c([N+](=O)[O-])cc1C 188594586 FTGDLLYLTFJBPW-UHFFFAOYSA-N 272.326 2.363 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)c1ccco1 8380510 ORMDKIPEPGMNMZ-UHFFFAOYSA-N 253.235 2.021 5 50 CEBA CC[C@H](Nc1nccc(CO)n1)c1cccc([N+](=O)[O-])c1 341606185 HZOFEVDIXZMMEA-ZDUSSCGKSA-N 288.307 2.440 5 50 CEBA Cc1cc(C(=O)N[C@H](C)[C@@H]2CCCO2)ccc1[N+](=O)[O-] 1056290 UQFFUXZXOBEKGG-MFKMUULPSA-N 278.308 2.201 5 50 CEBA C[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)CCS1 253432882 PJWCFKRELFSVJX-SECBINFHSA-N 253.327 2.322 5 50 CEBA CNc1c(Br)cc(C(=O)OC)cc1[N+](=O)[O-] 95496065 FOTHLHQXZIDLEF-UHFFFAOYSA-N 289.085 2.186 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCC(O)CC1 4988240 ITQBRKVMOQMIHO-HWKANZROSA-N 262.309 2.065 5 50 CEBA Nc1cccc([C@H](C[N+](=O)[O-])O[C@H]2CCCCO2)c1 72446987 YYTFIBZARMMTFA-STQMWFEESA-N 266.297 2.130 5 50 CEBA NC(=O)c1cncc(Oc2c(F)cc([N+](=O)[O-])cc2F)c1 170592925 YOORFSMZYVEGQA-UHFFFAOYSA-N 295.201 2.159 5 50 CEBA Cc1ccc(C)n1NC(=O)c1ccc([N+](=O)[O-])cc1 608903 WREVUESPBOJPAJ-UHFFFAOYSA-N 259.265 2.397 5 50 CEBA O=C(CC(=O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1 100718815 CDSAMNVLRSHLPN-UHFFFAOYSA-N 261.155 2.299 5 50 CEBA in-vitro O=[N+]([O-])c1cccc(-c2cn(O)c3c([n+]2=O)CCCC3)c1 334157305 KOLHDVMRVDJDNX-UHFFFAOYSA-N 288.283 2.094 5 50 CEBA O=[N+]([O-])c1ccc(F)cc1N(CCO)C1CCC1 228507057 ILAVUSZXUSOFQP-UHFFFAOYSA-N 254.261 2.085 5 50 CEBA CC(C)(C)c1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 1679576 WHTXLZQPQJAELS-UHFFFAOYSA-N 268.225 2.499 5 50 CEBA CNC(=O)c1cc2c(ccc3ccccc32)oc1=O 347556 QPDVDXFHRUWFQJ-UHFFFAOYSA-N 253.257 2.306 5 50 CEBA CC(=O)Nc1cc([N+](=O)[O-])ccc1Br 75282617 RTSTZQRSWJGBNU-UHFFFAOYSA-N 259.059 2.316 5 50 CEBA Cc1cnc(N2CC[C@@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])c1 408427017 YNTSLSKKTHZTBP-NEPJUHHUSA-N 277.324 2.161 5 50 CEBA N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4899460 GJHIOWXZFDVUKQ-AWEZNQCLSA-N 285.303 2.103 5 50 CEBA in-vitro COc1cc(CN2CCCC2)c([N+](=O)[O-])cc1OC 4988691 KVTYPQGYGXNKKG-UHFFFAOYSA-N 266.297 2.208 5 50 CEBA COC(=O)c1cc([N+](=O)[O-])c(Br)cc1C 137836325 MHWVNOZRKHYKEL-UHFFFAOYSA-N 274.070 2.452 5 50 CEBA CCc1cnc(CNc2nc(C)ccc2[N+](=O)[O-])o1 170601911 QQWOFIRZUDMMMZ-UHFFFAOYSA-N 262.269 2.461 5 50 CEBA CC(=O)CC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 442331 OBAOCZRCLUJHLZ-UHFFFAOYSA-N 256.645 2.166 5 50 CEBA O=[N+]([O-])c1ccc2c(c1)-c1ccccc1S2(=O)=O 1620306 RKNBFSKANRFUQQ-UHFFFAOYSA-N 261.258 2.408 5 50 CEBA O=[N+]([O-])c1cnc(Nc2ccccn2)c([N+](=O)[O-])c1 3880510 MGKYISWVTAZEAT-UHFFFAOYSA-N 261.197 2.037 5 50 CEBA Cc1ccc(OCc2ccc(C(N)=O)o2)c([N+](=O)[O-])c1 2785339 UINJUSVKGWHJSP-UHFFFAOYSA-N 276.248 2.174 5 50 CEBA C[C@H](C(=O)Nc1ccc(Cl)cn1)n1cc([N+](=O)[O-])cn1 1421985 RCDORMIBWFKNCS-SSDOTTSWSA-N 295.686 2.039 5 50 CEBA O=C(Nc1nncs1)c1ccc([N+](=O)[O-])cc1Cl 175372 LMWGYJAKKMDORM-UHFFFAOYSA-N 284.684 2.352 5 50 CEBA O=[N+]([O-])c1cnc2ncc(Br)cc2c1 1536221621 YTAGQTJQCSNOMS-UHFFFAOYSA-N 254.043 2.301 5 50 CEBA C[n+]1c(-c2ccc([N+](=O)[O-])cc2)cn2ccccc21 337557 KDYFVLGUKIGTDA-UHFFFAOYSA-N 254.269 2.339 5 50 CEBA CN1CC[C@@H]2CCN(c3cc(F)ccc3[N+](=O)[O-])[C@H]2C1 248789982 XDJXMUCHBUTNLS-YGRLFVJLSA-N 279.315 2.264 5 50 CEBA O=C(Nc1nccs1)c1cccc([N+](=O)[O-])c1C(=O)O 2472473 YDZRCKGQMSBDSI-UHFFFAOYSA-N 293.260 2.002 5 50 CEBA COc1ccc(C(=O)Nc2ncc([N+](=O)[O-])s2)cc1 4591315 DBHUGAVWJOUDKM-UHFFFAOYSA-N 279.277 2.312 5 50 CEBA CSc1nc2ncc3c(=O)oc4ccccc4c3n2n1 2325809644 SYLHPXKMXYJIRV-UHFFFAOYSA-N 284.300 2.106 5 50 CEBA C[C@H]1CN(c2ccc([N+](=O)[O-])c3cccnc23)C[C@H](C)N1 3877890 VUIFYXAJJLSBES-QWRGUYRKSA-N 286.335 2.330 5 50 CEBA COC[C@H](O)CNc1cc([N+](=O)[O-])ccc1C(F)(F)F 585133053 POURQKZBTXHCHJ-MRVPVSSYSA-N 294.229 2.033 5 50 CEBA O=C(N[C@H]1CC[C@H](O)CC1)c1ccc([N+](=O)[O-])c(Cl)c1 241124197 JGGIIIRCYKIMSM-MGCOHNPYSA-N 298.726 2.282 5 50 CEBA O=C(O)c1cc(Br)c(F)cc1[N+](=O)[O-] 74937743 SRAJUIZMZUCXQU-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA in-vitro CCOC(=O)c1cc(Br)c(O)c([N+](=O)[O-])c1 85477365 KRAMMRJISMDSHL-UHFFFAOYSA-N 290.069 2.240 5 50 CEBA in-vitro CC(C)(C)OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1666967 JETCTPYQTQUQPA-UHFFFAOYSA-N 268.225 2.458 5 50 CEBA in-vitro COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1C[C@H]1C 123028104 CBZXGNGUWMHPPJ-XCBNKYQSSA-N 265.269 2.133 5 50 CEBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(F)c(F)c1 1429409 VPXUZBJWFZCVRE-UHFFFAOYSA-N 296.233 2.017 5 50 CEBA COc1ccc(CN(C)[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] 241409007 NDTWQEMKGFYQRQ-TZMCWYRMSA-N 294.351 2.339 5 50 CEBA O=C(O)Cc1cccc(C(=O)c2ccccc2)c1[N+](=O)[O-] 26383637 GCWNYHQPWKBAFT-UHFFFAOYSA-N 285.255 2.453 5 50 CEBA COC(=O)c1cccc(-c2cccc([N+](=O)[O-])c2)n1 85479218 FKIMDQCPRPBQSA-UHFFFAOYSA-N 258.233 2.443 5 50 CEBA CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(c2ncc(C)cc2[N+](=O)[O-])[C@H]31 286501615 YHUAYXJMPJFGEY-FFNLUWKOSA-N 289.335 2.158 5 50 CEBA COC(=O)c1cccc(Br)c1[N+](=O)[O-] 47202239 RPVJUANCLHFOFR-UHFFFAOYSA-N 260.043 2.144 5 50 CEBA COCC(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc12 161847940 HMYFDSBANRLQIV-UHFFFAOYSA-N 275.264 2.036 5 50 CEBA O=C1CCN1c1cccc(Nc2ncccc2[N+](=O)[O-])c1 408515162 XCLVKUXJJONRQR-UHFFFAOYSA-N 284.275 2.470 5 50 CEBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)N1 3877880 UEIVDYVQWOFTJP-RKDXNWHRSA-N 269.732 2.435 5 50 CEBA CCOCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 4696171 OFXJFUHBRWWAOP-UHFFFAOYSA-N 258.661 2.223 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N[C@@H]2C[C@@H]3OCCC[C@H]32)c1 249204405 AWFYVODLDALFMD-CWSCBRNRSA-N 263.297 2.156 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N[C@@H]2C[C@@H]3OCCC[C@@H]32)c1 193524069 AWFYVODLDALFMD-BREBYQMCSA-N 263.297 2.156 5 50 CEBA NC(=O)N[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 439069 BNBVIBVYBOHGHC-ZDUSSCGKSA-N 271.276 2.353 5 50 CEBA O=[N+]([O-])c1cnc(NC[C@H]2CCCNC2)c(Cl)c1 236051837 RJELRIXSSNSRFR-QMMMGPOBSA-N 270.720 2.055 5 50 CEBA O=C(O)COc1ccc2c(=O)c3ccccc3oc2c1 196120559 VMCWSBGOSTUMTF-UHFFFAOYSA-N 270.240 2.410 5 50 CEBA CCN1CCN(c2cc(C)c([N+](=O)[O-])cc2F)CC1 4984005 CSSWGVDTMHAWRI-UHFFFAOYSA-N 267.304 2.184 5 50 CEBA C[C@H](CNc1ncc([N+](=O)[O-])s1)CC1(C)OCCO1 192461738 MKOVXVBGHMVUDU-QMMMGPOBSA-N 287.341 2.252 5 50 CEBA O=[N+]([O-])c1ccc(NS(=O)(=O)c2ccccc2)c(O)c1 5279582 NJLNHUHLXNVVBG-UHFFFAOYSA-N 294.288 2.101 5 50 CEBA N[C@@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5127888 JXBSDLZLJPIEJN-ZJUUUORDSA-N 280.284 2.185 5 50 CEBA CCNc1cc(C(=O)OCC)c([N+](=O)[O-])cc1F 725261744 FHCNGAOTOXZWFA-UHFFFAOYSA-N 256.233 2.342 5 50 CEBA O=[N+]([O-])c1cc(CN2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cs1 408075650 ZENPIZUGTGMZGU-NNYUYHANSA-N 280.349 2.266 5 50 CEBA NC(=S)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 2561983 HTPVNJFYYFCVPW-UHFFFAOYSA-N 280.334 2.374 5 50 CEBA in-vitro Cc1cc(NCc2cnc3n2CCC3)ncc1[N+](=O)[O-] 719936866 FQILGBSMILDNHZ-UHFFFAOYSA-N 273.296 2.053 5 50 CEBA CC(=O)Nc1ccc(SC(C)=O)cc1[N+](=O)[O-] 4582933 HKUYSYJKZLRLNX-UHFFFAOYSA-N 254.267 2.192 5 50 CEBA COc1ccc(C(=O)Nc2cccnc2)cc1[N+](=O)[O-] 180947 JMMMSJCOJLTFQB-UHFFFAOYSA-N 273.248 2.251 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1NCCN1CCCOCC1 188495944 DVOBMGNOGZCEFP-UHFFFAOYSA-N 279.340 2.037 5 50 CEBA Cn1cnc([N+](=O)[O-])c1CN1CCCC2(CCCC2)C1 408443965 PZMYVSFXVZATCV-UHFFFAOYSA-N 278.356 2.485 5 50 CEBA Cc1ccc([N+](=O)[O-])cc1NC(=S)NC[C@H]1CCCO1 5062862 LWLFBYMWTSWMNI-LLVKDONJSA-N 295.364 2.369 5 50 CEBA Nc1ccc(-c2ccc(N)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 3877934 OCEINMLGYDSKFW-UHFFFAOYSA-N 274.236 2.334 5 50 CEBA in-vitro CC[C@@H](OC(C)=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 4537325 NVRQCSAIOZHSQA-LLVKDONJSA-N 281.264 2.380 5 50 CEBA Cc1cccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] 466046 JQQHBAMVTIZNBY-QWRGUYRKSA-N 278.308 2.153 5 50 CEBA COCCOc1ccc(Br)cc1[N+](=O)[O-] 42389486 JDMAYXLFPMODFC-UHFFFAOYSA-N 276.086 2.383 5 50 CEBA in-vitro O=[N+]([O-])c1cccnc1NCc1cc2n(n1)CCCC2 585092482 ZPFGWBBBHXGTRA-UHFFFAOYSA-N 273.296 2.135 5 50 CEBA CCC[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517249 WSJNAXWRYWZIBW-SECBINFHSA-N 283.240 2.168 5 50 CEBA O=[N+]([O-])c1cccc([S@](=O)CC[C@@H]2CCCO2)c1 888097694 YWFUDSBHUMCPRG-BBATYDOGSA-N 269.322 2.272 5 50 CEBA Nc1nnc(SCc2ccccc2[N+](=O)[O-])s1 36134 XSXZELSKPDCQFR-UHFFFAOYSA-N 268.323 2.321 5 50 CEBA CC(C)CCNC(=O)Cc1ccccc1[N+](=O)[O-] 441508 CTVRLZIPYHTHEJ-UHFFFAOYSA-N 250.298 2.300 5 50 CEBA CCOC(=O)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4299722 DYEIOUCEYOYBPG-UHFFFAOYSA-N 278.308 2.374 5 50 CEBA in-vitro CS[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@@H]1N(C)C 270667533 QLGJJNHTKZGXQJ-UONOGXRCSA-N 295.408 2.072 5 50 CEBA NC(=O)N[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 439070 BNBVIBVYBOHGHC-CYBMUJFWSA-N 271.276 2.353 5 50 CEBA O=C(O)c1cc(C(F)(F)F)cc([N+](=O)[O-])c1F 85667139 FEGCOZKWDPXHID-UHFFFAOYSA-N 253.107 2.451 5 50 CEBA O=[N+]([O-])c1cccnc1SCCCn1ccnc1 185531926 ODQFAVCSFVNBLE-UHFFFAOYSA-N 264.310 2.369 5 50 CEBA Cc1cc(=O)n(CCc2ccccc2F)cc1[N+](=O)[O-] 408514556 OGUAKFUQODSAKW-UHFFFAOYSA-N 276.267 2.447 5 50 CEBA Cc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] 183298 LIYWCRBOFGSVOU-GHMZBOCLSA-N 278.308 2.153 5 50 CEBA O=[N+]([O-])c1cc(Cl)cnc1I 113531169 UXJODOZORLBGIZ-UHFFFAOYSA-N 284.440 2.248 5 50 CEBA O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1C[C@H]2CC[C@H]1C2 101445646 ANDBBOGXHAZHQE-DCAQKATOSA-N 296.348 2.062 5 50 CEBA O=[N+]([O-])c1cc(F)ccc1N[C@H]1CC[C@H](O)CC1 242687862 UYLPQPNACBGPER-MGCOHNPYSA-N 254.261 2.449 5 50 CEBA Cc1cc([N+](=O)[O-])cnc1N1CC(c2ccccn2)C1 585132786 VWDYIMCVIUUNHX-UHFFFAOYSA-N 270.292 2.297 5 50 CEBA O=C(Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1O 5049597 OEZLVXULIIZGTN-UHFFFAOYSA-N 272.260 2.482 5 50 CEBA O=C(c1ccc([N+](=O)[O-])o1)n1cnc2ccccc21 342234 PEAGYYWBJBZYKU-UHFFFAOYSA-N 257.205 2.226 5 50 CEBA Cc1nn(CCOCc2ccccc2)cc1[N+](=O)[O-] 594897555 OAPYJDUNCKENQJ-UHFFFAOYSA-N 261.281 2.317 5 50 CEBA O=[N+]([O-])c1ccc(N2CC[C@@H](c3cc[nH]n3)C2)c(F)c1 1775985655 JRHDQOMAVVRUQS-SECBINFHSA-N 276.271 2.451 5 50 CEBA CC(=O)c1ccc(N2CC[C@](C)(N(C)C)C2)c([N+](=O)[O-])c1 1615588605 CHTVOYNNRULIPQ-HNNXBMFYSA-N 291.351 2.328 5 50 CEBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1ccc(O)cc1 225799 WRPGJNGBYRQQJR-UHFFFAOYSA-N 284.227 2.101 5 50 CEBA C[C@H]1c2ccccc2OCCN1c1ncc([N+](=O)[O-])cn1 584908570 RYYCVYNRYNYNSE-JTQLQIEISA-N 286.291 2.345 5 50 CEBA COc1cc([N+](=O)[O-])c(OC)cc1N1C[C@H](C)O[C@H](C)C1 5211482 MJQZFWSVTOFJOB-AOOOYVTPSA-N 296.323 2.226 5 50 CEBA Cc1cccc(Nc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])n1 4982777 KUVHCTJZFWNJCJ-UHFFFAOYSA-N 275.224 2.345 5 50 CEBA CN1C(=N)S/C(=C/c2cccc([N+](=O)[O-])c2)C1=O 5018362 WJURVZRVEOJMSB-XBVDDGHGSA-N 263.278 2.076 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2)cc1 187398 OKABXQCJRCTYLI-UHFFFAOYSA-N 292.316 2.073 5 50 CEBA Cc1ccc(OCCCN2CCOCC2)c([N+](=O)[O-])c1 20118014 ZCXJMFPSQNAISL-UHFFFAOYSA-N 280.324 2.004 5 50 CEBA CSc1ccccc1Nc1ncnc(N)c1[N+](=O)[O-] 3912559 VBAVARKOZUSFOC-UHFFFAOYSA-N 277.309 2.433 5 50 CEBA O=[N+]([O-])c1ccc(N2CCCCC2)cc1[N+](=O)[O-] 3878524 DOOCCAPDLAKHML-UHFFFAOYSA-N 251.242 2.493 5 50 CEBA Cc1cc(C(=O)Nc2[nH]ncc2C)ccc1[N+](=O)[O-] 134677418 IQTBNNARHQRKKD-UHFFFAOYSA-N 260.253 2.187 5 50 CEBA CCOc1cccc(N2CC[C@@H](C)[C@@H](O)C2)c1[N+](=O)[O-] 221832513 HWPBIUFPDPSRRD-PWSUYJOCSA-N 280.324 2.201 5 50 CEBA COC(=O)CSc1[nH]c2ccc(F)cc2c1[N+](=O)[O-] 198964 HLNVLIYWSQDJAD-UHFFFAOYSA-N 284.268 2.480 5 50 CEBA C[C@H]1CN(c2ccc([N+](=O)[O-])c3cccnc23)C[C@@H](C)N1 3877888 VUIFYXAJJLSBES-PHIMTYICSA-N 286.335 2.330 5 50 CEBA Cc1cc(N2CCC(c3c[nH]cn3)CC2)ncc1[N+](=O)[O-] 253433325 VQAKXDUBVJCXTJ-UHFFFAOYSA-N 287.323 2.405 5 50 CEBA C[C@H]1CN(c2ccc([N+](=O)[O-])c(Cl)n2)C[C@H](C)O1 220972152 IQAPYMRQSUJETN-YUMQZZPRSA-N 271.704 2.257 5 50 CEBA O=C(c1cc([N+](=O)[O-])ccc1F)n1nnc2ccccc21 172975 HDAIQVMNPSJJLF-UHFFFAOYSA-N 286.222 2.167 5 50 CEBA O=[N+]([O-])c1ccc(N[C@H](CO)CC(F)(F)F)cc1 339699804 HBNIODQHKIIXAY-QMMMGPOBSA-N 264.203 2.320 5 50 CEBA O=[N+]([O-])c1cnc(N[C@@H]2C[C@H]3OCCC[C@H]23)s1 192544382 GGUPPSVKOWSVLG-BWZBUEFSSA-N 255.299 2.031 5 50 CEBA CCN1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 4903432 SYPFGXXKXKCIHW-UHFFFAOYSA-N 297.742 2.026 5 50 CEBA Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)cc1C 267610 NHCNITKAJPAPFK-UHFFFAOYSA-N 288.307 2.355 5 50 CEBA O=[N+]([O-])c1ccc(S(=O)(=O)NC2CCCCC2)cc1 295302 ZBRPMQHGXXEMSS-UHFFFAOYSA-N 284.337 2.206 5 50 CEBA Cc1ccc(NC(=O)[C@@H]2CCCO2)c([N+](=O)[O-])c1 4614016 VJCKWJKQOUDHAZ-NSHDSACASA-N 250.254 2.021 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H](CO)C1 4988917 VYUHYWOLTOTBRN-WXJAXGNASA-N 276.336 2.312 5 50 CEBA O=[N+]([O-])c1cc([N+](=O)[O-])c(C(F)(F)F)cc1O 71778753 XAGKJNHNPNHVCQ-UHFFFAOYSA-N 252.104 2.227 5 50 CEBA Cc1cc([N+](=O)[O-])ccc1N1CCC(CO)CC1 40453027 BGUYFXIKJGHKQS-UHFFFAOYSA-N 250.298 2.112 5 50 CEBA Nc1c([N+](=O)[O-])ccc2c1[N+](=O)C1(CCCCC1)N2O 334157069 DFBFLXWCLSAPIQ-UHFFFAOYSA-N 279.276 2.457 5 50 CEBA CCOC(=O)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 4819099 MFNIRRVDAVYYHI-UHFFFAOYSA-N 297.286 2.012 5 50 CEBA CN=c1[nH]nc(Sc2cc(C)sc2[N+](=O)[O-])s1 596067294 YYIKMRIMGAAOCB-UHFFFAOYSA-N 288.379 2.431 5 50 CEBA Cc1ccc(C)c(Nc2ncnc(N)c2[N+](=O)[O-])c1 3912579 WFUHCKMEVAOZHZ-UHFFFAOYSA-N 259.269 2.327 5 50 CEBA O=[N+]([O-])c1ccccc1OCCN1CCCCC1 4989876 WJKVNAGDMGTIQM-UHFFFAOYSA-N 250.298 2.460 5 50 CEBA O=[N+]([O-])c1cc2c(cc1Br)OCCO2 3887615 PBFAMONJVJBDQV-UHFFFAOYSA-N 260.043 2.129 5 50 CEBA C[C@H](CO)CNC(=O)c1ccc(C(C)(C)C)cc1[N+](=O)[O-] 1875293210 GPUQYHAPBNNOFY-JTQLQIEISA-N 294.351 2.251 5 50 CEBA Cn1ncc(Oc2ccc([N+](=O)[O-])cc2)c(Cl)c1=O 346181 XYKHHCYGPWCUAL-UHFFFAOYSA-N 281.655 2.134 5 50 CEBA O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1cccc([N+](=O)[O-])c1 431497 BMOSXQQEXQAGRU-UHFFFAOYSA-N 298.258 2.017 5 50 CEBA COc1cc(-c2ccc(C=O)cc2[N+](=O)[O-])ccn1 725242439 FKJAYUOJJNCLEF-UHFFFAOYSA-N 258.233 2.478 5 50 CEBA Cc1ccc(F)cc1Cn1ccc(=O)c([N+](=O)[O-])c1 188217248 GYYNRHZAJGBXQP-UHFFFAOYSA-N 262.240 2.252 5 50 CEBA NC(=O)CSc1nc(-c2cccc([N+](=O)[O-])c2)cs1 2890903 YAGNVMNWDNMUHE-UHFFFAOYSA-N 295.345 2.296 5 50 CEBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)N1 3877879 UEIVDYVQWOFTJP-IUCAKERBSA-N 269.732 2.435 5 50 CEBA O=[N+]([O-])c1c(O)c(F)cc(Br)c1F 307217368 CBHYBKFWYLJZJF-UHFFFAOYSA-N 253.986 2.341 5 50 CEBA C[C@H]1C[C@@H](C)CN(c2ccc([N+](=O)[O-])c(N)n2)C1 167783192 AIRBASRMKCIKSZ-DTORHVGOSA-N 250.302 2.054 5 50 CEBA CC1=CCCN(C(=O)c2cccc([N+](=O)[O-])c2O)C1 230812938 MHLSOTVWHGPQDQ-UHFFFAOYSA-N 262.265 2.093 5 50 CEBA O=[N+]([O-])c1cccc(CN2CCCC[C@@H]2CCO)c1 4948700 IHTYDVBLKIUXOX-CYBMUJFWSA-N 264.325 2.332 5 50 CEBA Cc1ccc([N+](=O)[O-])c(OCCN2C[C@H](C)O[C@H](C)C2)c1 16488947 GSXTXISIEHKLME-BETUJISGSA-N 294.351 2.391 5 50 CEBA C[C@H]1C(=O)C(C)(C)C(=O)O[C@H]1c1ccc([N+](=O)[O-])cc1 182553 LBIIJNHUKQSKIJ-LDYMZIIASA-N 277.276 2.424 5 50 CEBA N=C1NC(=O)/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)S1 4953770 NSRQEPDSABSJEH-XBXARRHUSA-N 283.696 2.387 5 50 CEBA Cc1cc(C(=O)N[C@@]2(C)CCCOC2)ccc1[N+](=O)[O-] 330655512 MUKIYHYVVGASKJ-AWEZNQCLSA-N 278.308 2.202 5 50 CEBA CCOCCN(C)C(=O)Nc1ccc([N+](=O)[O-])cc1C 163153865 GKQHBYXVFBQCFW-UHFFFAOYSA-N 281.312 2.403 5 50 CEBA O=[N+]([O-])c1ccc(N2CCC[C@H](c3cnn[nH]3)C2)c(F)c1 1775985686 QRSLSGVZPKHYTQ-VIFPVBQESA-N 291.286 2.236 5 50 CEBA Cc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] 183299 LIYWCRBOFGSVOU-QWRGUYRKSA-N 278.308 2.153 5 50 CEBA CCCCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 2479026 WUOCQJDBLLNLPF-UHFFFAOYSA-N 286.353 2.453 5 50 CEBA O=C1c2ccccc2C(=O)N1c1ccccc1[N+](=O)[O-] 3898275 FHPIULWDFMBJQJ-UHFFFAOYSA-N 268.228 2.395 5 50 CEBA COC(=O)c1cc([N+](=O)[O-])c(Br)s1 1601600 IKLHFNCFMCPBRU-UHFFFAOYSA-N 266.072 2.205 5 50 CEBA COc1ccc(CSc2nnc(N)s2)cc1[N+](=O)[O-] 2500743 SRVDWGQEXNXTOD-UHFFFAOYSA-N 298.349 2.329 5 50 CEBA Cc1cc(F)ccc1NC(=O)c1c([N+](=O)[O-])cnn1C 355640 VVTHOSIEFNPFMW-UHFFFAOYSA-N 278.243 2.028 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCNCC1 3887662 YOBUPGXTLFRIJD-UHFFFAOYSA-N 275.230 2.023 5 50 CEBA in-vitro O=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12 4521715 DJFNQJJTTPMBIL-UHFFFAOYSA-N 294.267 2.188 5 50 CEBA in-vitro CC1=CCN(CCNc2ncccc2[N+](=O)[O-])CC1 225602862 TZRIHSXUOJQJCO-UHFFFAOYSA-N 262.313 2.054 5 50 CEBA CCN1C(=O)S/C(=C/c2ccc([N+](=O)[O-])o2)C1=O 71772849 AFJFJFSCZPHPEV-FNORWQNLSA-N 268.250 2.244 5 50 CEBA O=C(NC[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1Cl 2900410 ODITUXZCDVCDMZ-SECBINFHSA-N 284.699 2.157 5 50 CEBA NC(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 4755303 JQOAZLREPAGGHC-UHFFFAOYSA-N 263.297 2.438 5 50 CEBA Cc1ccc(Sc2ncnc(N)c2[N+](=O)[O-])cc1 4059613 YRBWRJPQZVNWLE-UHFFFAOYSA-N 262.294 2.427 5 50 CEBA O=[N+]([O-])c1ccc(N2CCOCC2)cc1NC1CC1 4083481 GKQKQPZYGUVEQX-UHFFFAOYSA-N 263.297 2.006 5 50 CEBA O=[N+]([O-])c1cccnc1Sc1nnc(S)s1 2191299 APDJURLGRLOQEF-UHFFFAOYSA-N 272.336 2.281 5 50 CEBA COc1cccc(I)c1[N+](=O)[O-] 37631237 RINUUFLGNUBQLM-UHFFFAOYSA-N 279.033 2.208 5 50 CEBA O=[N+]([O-])c1c(F)cccc1I 16159791 SKOBGJNQMJCUOF-UHFFFAOYSA-N 266.997 2.339 5 50 CEBA in-vitro O=C(O)[C@@H]1CCCN1Sc1ccccc1[N+](=O)[O-] 14679714 ZVSQNFDSXRIAHI-VIFPVBQESA-N 268.294 2.151 5 50 CEBA O=c1nc2c3ccccc3ncn2nc1-c1ccc(F)cc1 585157972 YOORRBITWPJMKT-UHFFFAOYSA-N 292.273 2.444 5 50 CEBA O=C(c1ccc([N+](=O)[O-])cc1)c1nc2c(n1O)CCCC2 460437 CYLZQRKEVXZDBA-UHFFFAOYSA-N 287.275 2.138 5 50 CEBA O=C(Nc1ccc2sncc2c1)c1n[nH]cc1[N+](=O)[O-] 170089482 HCGYXABYTDLTCX-UHFFFAOYSA-N 289.276 2.180 5 50 CEBA CCN(CC)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 103447 JEDZEMCFLDJMQN-UHFFFAOYSA-N 252.270 2.085 5 50 CEBA Nc1ncnc(NCCc2c[nH]c3ccccc23)c1[N+](=O)[O-] 3912535 LNWRFAVDYZUAAF-UHFFFAOYSA-N 298.306 2.103 5 50 CEBA O=C(OCCN1CCCCC1)c1cccc([N+](=O)[O-])c1 4965048 FEGMIBDDEIQHPE-UHFFFAOYSA-N 278.308 2.238 5 50 CEBA Cc1cn([C@H](C)c2cncc(F)c2)nc1[N+](=O)[O-] 888095923 LAQHYQRCDUNPFA-MRVPVSSYSA-N 250.233 2.243 5 50 CEBA CCOC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 5196452 XRUYCGGHAQQEFP-UHFFFAOYSA-N 261.237 2.162 5 50 CEBA O=[N+]([O-])c1cncc([N+](=O)[O-])c1Nc1cccc(O)c1 5017055 PNSVEOKQAAHOLS-UHFFFAOYSA-N 276.208 2.347 5 50 CEBA Cc1cc(OCCN2C[C@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] 13153565 NHKYKIXKLYGSPU-BETUJISGSA-N 294.351 2.391 5 50 CEBA Cc1ccc(C(=O)O)c([N+](=O)[O-])c1Br 215553006 JZFRBFOZDYWGCP-UHFFFAOYSA-N 260.043 2.364 5 50 CEBA Nc1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 56591 DMZVYFFBWHBWMO-UHFFFAOYSA-N 278.289 2.010 5 50 CEBA in-vitro O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1Cl 3885257 BYKGYPUOJVMANL-UHFFFAOYSA-N 290.728 2.033 5 50 CEBA O=C(N[C@@H]1CC[C@H]2CCC[C@H]2C1)c1n[nH]cc1[N+](=O)[O-] 408031152 KZSAAHVQBGCVFM-KXUCPTDWSA-N 278.312 2.017 5 50 CEBA Cc1cc(C)nc(N(C#N)Cc2ccc([N+](=O)[O-])cc2)n1 470534 UPFZVCOEWTYUES-UHFFFAOYSA-N 283.291 2.489 5 50 CEBA O=C(O[C@@H]1CC[C@H]2CC[C@H]1O2)c1ccc([N+](=O)[O-])cc1 101036305 YENKBFVBBODBLU-JHJVBQTASA-N 277.276 2.462 5 50 CEBA Cc1nc(N2CC[C@H](c3cnccn3)C2)ccc1[N+](=O)[O-] 1612966749 JXLQGTQXXNJCHS-NSHDSACASA-N 285.307 2.082 5 50 CEBA C[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 271798 IBATUZBCIWHCAC-JTQLQIEISA-N 284.337 2.158 5 50 CEBA CCC[C@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 442359 FVZKLIUUZLZZFN-VIFPVBQESA-N 272.326 2.062 5 50 CEBA CC(C)N1[C@H]2C[C@@H]1CN(c1ccc([N+](=O)[O-])cc1)C2 215980207 IEQGFYAVJRGMBA-OKILXGFUSA-N 261.325 2.266 5 50 CEBA CC1(C)CN(c2ccc([N+](=O)[O-])cn2)Cc2c[nH]nc21 1775987688 SVBLVAWYFVETBJ-UHFFFAOYSA-N 273.296 2.011 5 50 CEBA Cc1cncn1C1CCN(c2ncccc2[N+](=O)[O-])CC1 170619642 VTLLQIDOCSPEPJ-UHFFFAOYSA-N 287.323 2.336 5 50 CEBA C[C@@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CCN1 4005708 GIRKMKZFBUAZMN-MRVPVSSYSA-N 255.705 2.046 5 50 CEBA O=C(O)c1cc2ccc3ccccc3c2n2nnnc12 526059764 SZCOJSAYHQLVGG-UHFFFAOYSA-N 264.244 2.129 5 50 CEBA O=[N+]([O-])c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 3896050 MPGYUYKSTWTQFS-UHFFFAOYSA-N 251.242 2.493 5 50 CEBA Nc1ccc([N+](=O)[O-])c(N[C@H]2c3ccccc3C[C@H]2O)c1 192788930 LMNHQNQJPZWYFW-CABCVRRESA-N 285.303 2.247 5 50 CEBA O=C(O)c1ccc(Nc2ccc([N+](=O)[O-])cn2)cc1 3880516 NPWJAJJRRULVHY-UHFFFAOYSA-N 259.221 2.432 5 50 CEBA COC[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1Cl 456446 QTQJCQNQFUBANR-ZETCQYMHSA-N 272.688 2.013 5 50 CEBA O=[N+]([O-])c1ccc(NC[C@@H]2CCCO2)c([N+](=O)[O-])c1 4082411 VKWUSZOSOIHTOV-VIFPVBQESA-N 267.241 2.094 5 50 CEBA O=[N+]([O-])c1ccccc1NS(=O)(=O)c1cccs1 6352494 AEYZAEXMPDUVJR-UHFFFAOYSA-N 284.318 2.457 5 50 CEBA O=C(O)c1ccc2ccc3ccc(C(=O)O)nc3c2n1 5225031 FXSVCROWUPWXBP-UHFFFAOYSA-N 268.228 2.179 5 50 CEBA C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 17126046 MFOLKAPJNYBJFJ-AOOOYVTPSA-N 279.296 2.236 5 50 CEBA C[C@@H](CC[N+](C)(C)C)OC(=O)[C@@H]1OCCc2ccccc21 220132897 VCKFCODGNHIGOS-XJKSGUPXSA-N 292.399 2.328 5 50 CEBA CO[C@H]1CCCC[C@@H]1Nc1ncc([N+](=O)[O-])s1 240871408 IKIRNKKANCUICK-YUMQZZPRSA-N 257.315 2.421 5 50 CEBA CCCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 2831362 FRDMBQIKWIJULT-UHFFFAOYSA-N 272.326 2.063 5 50 CEBA C[C@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 20167218 WRAUOSVUGOEMOS-STQMWFEESA-N 294.351 2.473 5 50 CEBA COC(=O)c1cc(Br)c(F)cc1[N+](=O)[O-] 97756698 NZMDRZXCOIKKOT-UHFFFAOYSA-N 278.033 2.283 5 50 CEBA O=C(CN1CCCCCC1)Nc1ccccc1[N+](=O)[O-] 5063873 QOWCJJCHFBNUSO-UHFFFAOYSA-N 277.324 2.409 5 50 CEBA Cc1cnc(N2CCO[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 230145334 NWTMJIUPRKIZCO-DGCLKSJQSA-N 277.324 2.446 5 50 CEBA Cc1ccc(-c2cnc(C(=O)O)nc2)cc1[N+](=O)[O-] 675070250 UBYGVOMHDNSNGK-UHFFFAOYSA-N 259.221 2.058 5 50 CEBA O=[N+]([O-])c1ccc(NC(=S)N2CCCC2)cc1 4562206 FITXPAKMKGDVCE-UHFFFAOYSA-N 251.311 2.387 5 50 CEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCCC[C@@H]1CO 6528516 RJVZKZOXOOVCRK-HZRUHFOJSA-N 276.336 2.455 5 50 CEBA Cc1ccnc(N2CCC[C@@]3(CCN(C)C3)C2)c1[N+](=O)[O-] 585092036 BXMQWANTOFEKCO-HNNXBMFYSA-N 290.367 2.220 5 50 CEBA O=c1c([N+](=O)[O-])cccn1Cc1cccc(Cl)c1 1431935 XONHIUOTCAGQSE-UHFFFAOYSA-N 264.668 2.458 5 50 CEBA O=C1[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1ccccc1[N+](=O)[O-] 100171571 JHIYHOXVZRXRNS-TXFQPVFDSA-N 298.298 2.296 5 50 CEBA CC(=O)Cc1ccc(Br)cc1[N+](=O)[O-] 63022963 FIUOHGYINUTMQZ-UHFFFAOYSA-N 258.071 2.489 5 50 CEBA in-vitro Cc1ccnc(N[C@@H]2C[C@@H](C)N(C3CC3)C2)c1[N+](=O)[O-] 133552170 FGDPXEMIHPAZRY-GHMZBOCLSA-N 276.340 2.335 5 50 CEBA COc1cc2c(cc1OC)[C@H](C)[N@+](C)(C[C@@H](C)O)CC2 252441046 CDGPCRFXVCWTDY-PEBVRCNWSA-N 280.388 2.148 5 50 CEBA biogenic COc1ccc(Cl)cc1Nc1ncnc(N)c1[N+](=O)[O-] 3912590 PCQHCRQJGVJALH-UHFFFAOYSA-N 295.686 2.373 5 50 CEBA CCC[C@@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 442358 FVZKLIUUZLZZFN-SECBINFHSA-N 272.326 2.062 5 50 CEBA Cc1cc(C)c(NS(=O)(=O)C(F)(F)F)c([N+](=O)[O-])c1 3832533 PRWHYSBHYWCJAL-UHFFFAOYSA-N 298.242 2.473 5 50 CEBA CC[C@@H](C)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 4700211 TWXPRMXUQHHGJM-GFCCVEGCSA-N 291.351 2.151 5 50 CEBA O=C(O)c1ccc(Br)c([N+](=O)[O-])c1F 306904837 VHVZJUGOZVJLBB-UHFFFAOYSA-N 264.006 2.195 5 50 CEBA CCCC(CCC)CNc1[nH]cnc(=N)c1[N+](=O)[O-] 170615445 VBTNXKPCPRJJAO-UHFFFAOYSA-N 267.333 2.426 5 50 CEBA C[C@H]1CCN(c2nc(N3CC[C@@H](C)C3)ncc2[N+](=O)[O-])C1 585092762 MQXXDFGQZSBDLL-WDEREUQCSA-N 291.355 2.077 5 50 CEBA Cc1ccc(O)c(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 435177 GODXUKJVRHMFBB-UHFFFAOYSA-N 298.254 2.409 5 50 CEBA CO[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1O)C(C)(C)C 155700925 QYBRWLGHUYNFAA-NSHDSACASA-N 296.323 2.091 5 50 CEBA Cn1cnc([N+](=O)[O-])c1NCCCSc1ccccn1 585092289 NQCZTLKFJODYBO-UHFFFAOYSA-N 293.352 2.318 5 50 CEBA O=C(N[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1n[nH]cc1[N+](=O)[O-] 408031153 KZSAAHVQBGCVFM-LPEHRKFASA-N 278.312 2.017 5 50 CEBA CC(=O)NCCCc1oc2ccc(O)cc2c1[N+](=O)[O-] 5073811 PKJCPXBDORHKCR-UHFFFAOYSA-N 278.264 2.115 5 50 CEBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 255473 QWUNRULDLDWOOC-IUCAKERBSA-N 298.726 2.498 5 50 CEBA Nc1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)s1 2338255 UZYXSTSOXAKNDU-UHFFFAOYSA-N 296.333 2.004 5 50 CEBA Cc1ccc(NC[C@H]2CC(=O)N(C3CC3)C2)c([N+](=O)[O-])c1 272550567 TYCGWTHDECAOBY-LLVKDONJSA-N 289.335 2.326 5 50 CEBA N=C1NC(=O)/C(=C\C=C\c2ccccc2[N+](=O)[O-])S1 16675538 HQJURLKCMMBMLG-RVAGFXNCSA-N 275.289 2.290 5 50 CEBA CCC[C@@H](C)NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 449771 MORNFVRCBGZSAH-SECBINFHSA-N 294.307 2.300 5 50 CEBA Cc1nnc(Sc2ncccc2[N+](=O)[O-])s1 480105 KVMNTVFDQCRUMR-UHFFFAOYSA-N 254.296 2.301 5 50 CEBA O=C(O)Cc1cc(Br)c(F)cc1[N+](=O)[O-] 97447193 AURFTGPECNOWBJ-UHFFFAOYSA-N 278.033 2.124 5 50 CEBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccccc2O)c1 3832831 FEFUMBFOUOVWMC-UHFFFAOYSA-N 294.288 2.101 5 50 CEBA C[C@H]1[C@H](C)CCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 119131050 LRIHZGMSFLLNRM-BDAKNGLRSA-N 264.281 2.171 5 50 CEBA CNC1(CNc2ccc(C(C)=O)cc2[N+](=O)[O-])CCC1 408523104 OXFCDSSMLSBKNM-UHFFFAOYSA-N 277.324 2.351 5 50 CEBA Cc1ccc(CNCC2([S@@](C)=O)CCC2)cc1[N+](=O)[O-] 280523515 BFWMPVLQXZQSIC-HXUWFJFHSA-N 296.392 2.294 5 50 CEBA O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]2CC[C@H]1C2 101797719 RQTRIAQNWDLFFL-GMXVVIOVSA-N 274.320 2.442 5 50 CEBA CCOC(C)(C)CNC(=O)c1c(C)cccc1[N+](=O)[O-] 192618430 HVKJGUARCKYIPF-UHFFFAOYSA-N 280.324 2.448 5 50 CEBA CC1=NO[C@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 585119955 CGSOFRVQFSIZBE-JTQLQIEISA-N 292.295 2.190 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2cccc3ccccc23)N1 105423 VSTQRSGTVPVEOS-ZFWWWQNUSA-N 270.288 2.436 5 50 CEBA CN=[S@@](C)(=O)CCNc1ccc(Cl)cc1[N+](=O)[O-] 408518777 ZGZSULWCRQNGQN-SFHVURJKSA-N 291.760 2.388 5 50 CEBA O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@H](O)C2)c1 241391 VOVWXRBCGOSETA-LLVKDONJSA-N 270.716 2.205 5 50 CEBA CCc1ccc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)cc1 273357 OZZDCYBSVDADHL-UHFFFAOYSA-N 288.307 2.301 5 50 CEBA Cc1c(Br)nnn1-c1ccc([N+](=O)[O-])cc1 96032197 GHXLOBVSJYGMPK-UHFFFAOYSA-N 283.085 2.246 5 50 CEBA CC(=O)N1CCc2c1ccc(Br)c2[N+](=O)[O-] 66322754 SFJNUMBLZKWIHK-UHFFFAOYSA-N 285.097 2.266 5 50 CEBA CCOC(=O)c1nc(O)c2cc3ccccc3nc2n1 5575674 JBRDALJZMUEMPV-UHFFFAOYSA-N 269.260 2.060 5 50 CEBA C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 13152048 AYPUWLHKVAJKHN-PHIMTYICSA-N 298.364 2.261 5 50 CEBA C[C@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 23115142 XIGGMEHFOAGNCY-QWRGUYRKSA-N 250.298 2.204 5 50 CEBA O=[N+]([O-])c1ccc(OC[C@H](O)CNc2ccccc2)cc1 5090730 ZHSMCWBQWSHBJI-CQSZACIVSA-N 288.303 2.447 5 50 CEBA Nc1nnc(-c2ccc(Cl)c([N+](=O)[O-])c2)s1 311328 WLGLOYIGRVKHKB-UHFFFAOYSA-N 256.674 2.349 5 50 CEBA in-vitro O=C(O)CCCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 3080959 YAVQFUQPULFNBD-UHFFFAOYSA-N 286.671 2.442 5 50 CEBA O=C(NC1=NCCS1)c1ccc([N+](=O)[O-])cc1Cl 258596 LRKPFEMTCNKJSS-UHFFFAOYSA-N 285.712 2.081 5 50 CEBA CCC(C)(C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 620093 XJYVTKFHTRITJH-UHFFFAOYSA-N 272.326 2.062 5 50 CEBA CC1CCN(c2ccc3nonc3c2[N+](=O)[O-])CC1 4010557 BXPHHGCGWYREET-UHFFFAOYSA-N 262.269 2.367 5 50 CEBA CCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Cl 1676678 UGNMHSAEARMZRD-UHFFFAOYSA-N 274.616 2.333 5 50 CEBA O=C(N1CCc2cc([N+](=O)[O-])ccc21)C(F)(F)F 117983818 ASCUQQCSZWBWBO-UHFFFAOYSA-N 260.171 2.046 5 50 CEBA CCN1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 238647 UYIORSOVURCUCU-UHFFFAOYSA-N 283.759 2.386 5 50 CEBA O=C(c1cc([N+](=O)[O-])ccc1Cl)n1cccn1 475171 CFXNOYGOGQUSPT-UHFFFAOYSA-N 251.629 2.133 5 50 CEBA CCN(CC)CCCNC(=O)c1ccc([N+](=O)[O-])c(C)c1 2736228 CLWJWEWZEKEIBW-UHFFFAOYSA-N 293.367 2.365 5 50 CEBA Cc1cnc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)s1 2880898 WODPEQCVARYVPA-UHFFFAOYSA-N 289.272 2.160 5 50 CEBA Nc1nc(Cl)nc(NCc2ccccc2)c1[N+](=O)[O-] 3893264 IWTGRKNTAFWZOH-UHFFFAOYSA-N 279.687 2.233 5 50 CEBA O=[N+]([O-])c1cccc(-c2nnc3ccc(Cl)nn23)c1 283466 VYCIKTMXEFYHIP-UHFFFAOYSA-N 275.655 2.353 5 50 CEBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2cccc3ccccc23)N1 105425 VSTQRSGTVPVEOS-DZGCQCFKSA-N 270.288 2.436 5 50 CEBA CCN(CC)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 2831442 URMZFWSSVYBSTC-UHFFFAOYSA-N 281.268 2.293 5 50 CEBA biogenic CN(C(=O)Nc1cccc([N+](=O)[O-])c1)[C@H](CO)C(C)(C)C 170681428 PAMTZNGGOGIUJL-GFCCVEGCSA-N 295.339 2.466 5 50 CEBA O=C(Nc1ncccc1O)c1c[nH]c2ccc([N+](=O)[O-])cc12 195246045 CZJNBWHJBNINAZ-UHFFFAOYSA-N 298.258 2.429 5 50 CEBA O=[N+]([O-])c1ccc(NC(=S)Nc2cnccn2)cc1 5041393 RWVCAVLDEOUZQT-UHFFFAOYSA-N 275.293 2.194 5 50 CEBA NCCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4599162 GPIAUHZGDZGEJK-UHFFFAOYSA-N 263.219 2.374 5 50 CEBA CCCC(=O)Nc1cc([N+](=O)[O-])ccc1N1CCOCC1 334161116 UCBRQIHRFFISQG-UHFFFAOYSA-N 293.323 2.170 5 50 CEBA O=C(Nc1ccc([N+](=O)[O-])c(NC(=O)C2CC2)c1)C1CC1 4903855 CYBXNJUGZHEZTP-UHFFFAOYSA-N 289.291 2.292 5 50 CEBA Cc1ccnc(N2CCN[C@@H](c3ccccc3)C2)c1[N+](=O)[O-] 952880482 BMNAQAUQCWARJF-CQSZACIVSA-N 298.346 2.449 5 50 CEBA CC(C)[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)C(N)=O 225872387 YNHSKLLNUOBXSB-JTQLQIEISA-N 271.704 2.170 5 50 CEBA CN1CC[C@H]2[C@@H](CCN2Cc2cccc([N+](=O)[O-])c2)C1 221747931 IYCFHXCRFYYJHY-ZFWWWQNUSA-N 275.352 2.121 5 50 CEBA O=c1c([N+](=O)[O-])c[nH]c2c(OC(F)(F)F)cccc12 1535543459 WQBGFILCFMBZOY-UHFFFAOYSA-N 274.154 2.335 5 50 CEBA O=C(/C=C/c1ccccc1[N+](=O)[O-])NCc1cccnc1 466209 BOSPMJRCPQOJBV-BQYQJAHWSA-N 283.287 2.319 5 50 CEBA C[C@@H]1C[C@@H](C)CN(c2ccc([N+](=O)[O-])c(N)n2)C1 167783408 AIRBASRMKCIKSZ-RKDXNWHRSA-N 250.302 2.054 5 50 CEBA O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccccc2)c1 5093267 ISVXNQHRTOHOHO-UHFFFAOYSA-N 292.316 2.073 5 50 CEBA O=C(Nc1ncc([N+](=O)[O-])s1)c1ccccc1O 5924265 FDTZUTSGGSRHQF-UHFFFAOYSA-N 265.250 2.009 5 50 CEBA world O=[N+]([O-])c1ncn(Cc2ccc(F)cc2Cl)n1 614338 GIFQUJUIHVNYAV-UHFFFAOYSA-N 256.624 2.027 5 50 CEBA O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@](F)(CO)C1 253392795 GIZAGSSBJCTMEU-LLVKDONJSA-N 274.679 2.159 5 50 CEBA O=[N+]([O-])c1ccc(N[C@@H](CO)CC(F)(F)F)cc1 339699803 HBNIODQHKIIXAY-MRVPVSSYSA-N 264.203 2.320 5 50 CEBA O=C(NCc1ccncc1)Nc1cccc([N+](=O)[O-])c1 609558 RXINOIWLACVPQD-UHFFFAOYSA-N 272.264 2.312 5 50 CEBA O=C1CN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2N1 1514408 CDKXCBOWQZABGH-UHFFFAOYSA-N 297.270 2.194 5 50 CEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1NN1CCOCC1 58632730 XUPDNGHJBHPAKD-UHFFFAOYSA-N 291.229 2.273 5 50 CEBA in-vitro O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1C(=O)O 233250 WLUJSGQJOUITAU-NWDGAFQWSA-N 292.291 2.424 5 50 CEBA Nc1ncnc(Oc2ccc(Cl)cc2)c1[N+](=O)[O-] 4059604 MEFYOVCNZLFLGG-UHFFFAOYSA-N 266.644 2.413 5 50 CEBA