smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C1CCCC[C@H]1c1ccc([N+](=O)[O-])cc1 39233584 FUKJIPWYXHNEPY-NSHDSACASA-N 219.240 2.822 5 40 BFBB O=[N+]([O-])c1ccc(O)c(Cc2ccccc2)c1 20268444 LPZJACDNYUKILW-UHFFFAOYSA-N 229.235 2.891 5 40 BFBB in-vitro O=[N+]([O-])c1ccccc1OC1CCCC1 67800542 ZFXCQLIFNOHBFI-UHFFFAOYSA-N 207.229 2.916 5 40 BFBB CCOC(=O)/C=C(\C)c1ccc([N+](=O)[O-])cc1 1746870 GXKAVJLXZLKIAJ-CMDGGOBGSA-N 235.239 2.561 5 40 BFBB O=[N+]([O-])c1ccc([C@@H]2C[C@@]2(F)Cl)cc1 4671680 RBYIEBIWCJVVCR-IUCAKERBSA-N 215.611 2.987 5 40 BFBB Cc1ccc(SCCN(C)C)c([N+](=O)[O-])c1 95436099 DKBHTJBLLHISGU-UHFFFAOYSA-N 240.328 2.557 5 40 BFBB O=[N+]([O-])c1cccnc1NCCc1ccccc1 20135276 NYKXEFZUYFKCAW-UHFFFAOYSA-N 243.266 2.644 5 40 BFBB Cc1cc([N+](=O)[O-])cc(Cl)c1N(C)C 45958897 RCACTDUPCBOXSX-UHFFFAOYSA-N 214.652 2.623 5 40 BFBB C[N+]1(C)C[C@@H]2CCC(Cl)=C(Cl)[C@H]2C1 494847 JIIWFHHPAIWXFI-YUMQZZPRSA-N 221.151 2.792 5 40 BFBB Cc1c2ccccc2cc[n+]1CCC[N+](C)(C)C 1998290 QUTBWHQXSHPJFM-UHFFFAOYSA-N 244.382 2.532 5 40 BFBB O=[N+]([O-])c1c(F)cccc1N1CCCCC1 48567848 SAXCRAPSTHMTNK-UHFFFAOYSA-N 224.235 2.724 5 40 BFBB Cc1cc(-n2cccc2C=O)ccc1[N+](=O)[O-] 8701944 WREBEYYWHUPKNN-UHFFFAOYSA-N 230.223 2.506 5 40 BFBB COc1ccc2ncc([N+](=O)[O-])c(Cl)c2c1 34433571 LWTIOURVXLFSTA-UHFFFAOYSA-N 238.630 2.805 5 40 BFBB C[C@@H]1CNc2ccc([N+](=O)[O-])cc2S1 95644358 IRNFWVVQNLUOLF-ZCFIWIBFSA-N 210.258 2.501 5 40 BFBB O=[N+]([O-])c1cnccc1Nc1ccccc1 4853075 PDYTVCBMTYEETA-UHFFFAOYSA-N 215.212 2.733 5 40 BFBB CCCC[C@@H](CC)C[N+]1(C)CCOCC1 1557600 KKRGSSZASJPMRF-CYBMUJFWSA-N 214.373 2.680 5 40 BFBB O=[N+]([O-])c1cc(Cl)c(F)cc1OC(F)F 95215539 LCKJWPFUWOGJSI-UHFFFAOYSA-N 241.552 2.989 5 40 BFBB Cc1ccc(OC(F)F)c([N+](=O)[O-])c1 71791942 QMXOHSHRKHVPOY-UHFFFAOYSA-N 203.144 2.505 5 40 BFBB O=[N+]([O-])c1ccc2nc(C(F)(F)Cl)[nH]c2c1 72265962 RDWNGNZWBZUSAZ-UHFFFAOYSA-N 247.588 2.759 5 40 BFBB O=c1[nH]c2c(ccc3cnccc32)c2c1CCC2 17061925 MXLQFLFNRRWURU-UHFFFAOYSA-N 236.274 2.565 5 40 BFBB CCC(=O)N[C@@H](CC)c1cccc([N+](=O)[O-])c1 96454692 YAMZPKGHHARRJF-NSHDSACASA-N 236.271 2.572 5 40 BFBB O=[N+]([O-])[C@@H]1CC[C@@H]2CC[C@@H]3CCC[C@@H]1[C@H]32 5328130 WUTRGTKNJPEJDE-KKJSVHSVSA-N 209.289 2.868 5 40 BFBB CCCc1noc(-c2cccc([N+](=O)[O-])c2)n1 430465 WJQSJKQHLVFMIJ-UHFFFAOYSA-N 233.227 2.597 5 40 BFBB C[N+]1(C)C[C@H]2CCC(Cl)=C(Cl)[C@H]2C1 494845 JIIWFHHPAIWXFI-SFYZADRCSA-N 221.151 2.792 5 40 BFBB Nc1cccc(OCc2cccc([N+](=O)[O-])c2)c1 1699667 QMVWGEOAJITWRK-UHFFFAOYSA-N 244.250 2.756 5 40 BFBB O=[N+]([O-])c1ccccc1N1CCCCCC1 4361771 SXHDLBJNZIRUKN-UHFFFAOYSA-N 220.272 2.975 5 40 BFBB Cc1ccc(C(=O)Nc2ccccc2[N+](=O)[O-])o1 5364064 QHZHFGAJVCAWKB-UHFFFAOYSA-N 246.222 2.749 5 40 BFBB O=[N+]([O-])c1ccc(Cl)cc1OC(F)F 84193143 FVGQBSQDQICCHZ-UHFFFAOYSA-N 223.562 2.850 5 40 BFBB in-vitro O=[N+]([O-])[C@@H]1CC=CC[C@@H]1c1ccccc1 1561808 UXWVJBRZRRCUHU-VXGBXAGGSA-N 203.241 2.766 5 40 BFBB Cc1cc2nnc3cc(C)cc4nnc(c1)c2c34 1703225 WFOJRNJNPFGYAU-UHFFFAOYSA-N 234.262 2.781 5 40 BFBB N[C@@H](CO)c1cc2ccccc2c2ccccc12 72198833 BRIIWJQPHNXXJA-INIZCTEOSA-N 237.302 2.985 5 40 BFBB Nc1ccc(-c2ccccc2[N+](=O)[O-])cc1 35798 RAKGZQHZUMWEFW-UHFFFAOYSA-N 214.224 2.844 5 40 BFBB in-vitro C[C@@H]1CCCCN1C(=O)c1cccc([N+](=O)[O-])c1 5515815 JRESSPPYACPTSL-SNVBAGLBSA-N 248.282 2.609 5 40 BFBB COc1cc2ccccc2cc1[N+](=O)[O-] 71256817 GKQHULHPBJRLTG-UHFFFAOYSA-N 203.197 2.757 5 40 BFBB Cc1cc(NC(=O)C(C)(C)F)ccc1[N+](=O)[O-] 182425180 NCIMCAFDFKFFJW-UHFFFAOYSA-N 240.234 2.590 5 40 BFBB O=Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 37974048 JAIHSHSJTRWSNB-UHFFFAOYSA-N 234.236 2.531 5 40 BFBB C/C=C/C=C/C(=O)Nc1cccc([N+](=O)[O-])c1C 8907366 IQOGPMXGFPZWRV-PRKJJMSOSA-N 246.266 2.974 5 40 BFBB CCCC[N+]1(C)CCN=C1Cc1ccccc1 31924814 BVGNNQTXNFFOJT-UHFFFAOYSA-N 231.363 2.888 5 40 BFBB COc1cc([N+](=O)[O-])cc(Cl)c1Cl 59595245 LYFAMXRWZNBHLH-UHFFFAOYSA-N 222.027 2.910 5 40 BFBB Cc1nn([C@@H](C)C(F)(F)F)c(C)c1[N+](=O)[O-] 84008327 PVRQIAAYIFSBDZ-LURJTMIESA-N 237.181 2.531 5 40 BFBB Cc1nn([C@H](C)C(F)(F)F)c(C)c1[N+](=O)[O-] 84008330 PVRQIAAYIFSBDZ-ZCFIWIBFSA-N 237.181 2.531 5 40 BFBB CC[N+](C)(CC)[C@H](C)c1ccc(C(=O)OC)o1 507416 ACKMZFXYIWENHQ-SNVBAGLBSA-N 240.323 2.614 5 40 BFBB O=C1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1 4823676 MNSJCNRFDNFFBF-NSHDSACASA-N 234.255 2.518 5 40 BFBB CC[C@H](C)Nc1nn(C(C)C)cc1[N+](=O)[O-] 95098513 RMVVHDCEMKECMI-QMMMGPOBSA-N 226.280 2.583 5 40 BFBB CCOc1ccc([N+](=O)[O-])c2ncccc12 95829563 SYPFGXBCHNDPAR-UHFFFAOYSA-N 218.212 2.542 5 40 BFBB in-vitro O=[N+]([O-])c1cccc2cc(Cl)cnc12 37631285 LURBIXAVAXWTEE-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB O=[N+]([O-])c1cnc2c(F)cccc2c1Cl 39076505 IYGRDXZBIHWZNR-UHFFFAOYSA-N 226.594 2.936 5 40 BFBB Nc1ccc([N+](=O)[O-])cc1Oc1ccccc1 4366220 CGQKBVHAWXBMCL-UHFFFAOYSA-N 230.223 2.969 5 40 BFBB O=[N+]([O-])c1ccc2[nH]nc(-c3ccncc3)c2c1 91366457 NXGOHIPRXHGBMP-UHFFFAOYSA-N 240.222 2.533 5 40 BFBB in-vitro O=[N+]([O-])c1cc(-c2nc3ccncc3[nH]2)cs1 97022113 FANUBJLIMGVMIO-UHFFFAOYSA-N 246.251 2.595 5 40 BFBB CC(=O)Nc1ccc([N+](=O)[O-])cc1C(C)(C)C 19873058 QEVJUFJHKCKVRE-UHFFFAOYSA-N 236.271 2.851 5 40 BFBB O=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2)o1 27829293 OEWNJEBZKMCENG-UHFFFAOYSA-N 233.179 2.793 5 40 BFBB Cc1nc2ccc([N+](=O)[O-])c(C)c2s1 45237324 HEOKPYZLZXUPJB-UHFFFAOYSA-N 208.242 2.821 5 40 BFBB O=[N+]([O-])c1cccc(-c2ncnc3ccoc23)c1 2362804727 JLDGOVBMPZBKNY-UHFFFAOYSA-N 241.206 2.798 5 40 BFBB COc1ccc2cc([N+](=O)[O-])ccc2c1C=O 3844676 BLZILWYUARZODK-UHFFFAOYSA-N 231.207 2.569 5 40 BFBB biogenic CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 12618851 FMTOIOKBFIQIKL-UHFFFAOYSA-N 232.239 2.574 5 40 BFBB Cc1ccc([C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 226291393 MWPUENMZTBDUPE-CQSZACIVSA-N 243.262 2.985 5 40 BFBB O=[N+]([O-])c1cccc(OC(F)F)c1Cl 95215601 FQCZSIPSMVYVJW-UHFFFAOYSA-N 223.562 2.850 5 40 BFBB O=[N+]([O-])c1ccc2[nH]c3cnccc3c2c1 5581435 OMKXGOVZKHGTEL-UHFFFAOYSA-N 213.196 2.624 5 40 BFBB Cc1ccsc1CNc1ccc([N+](=O)[O-])cn1 26730660 DTRUCATWOOOYRW-UHFFFAOYSA-N 249.295 2.972 5 40 BFBB COC[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 96034465 VBNFAZYMYFVMFE-SSDOTTSWSA-N 245.662 2.662 5 40 BFBB CCc1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1[N+](=O)[O-] 27317783 OZISJYPFMKWAJP-KWQFWETISA-N 248.282 2.752 5 40 BFBB Cc1cccc(-c2ccc(C=O)o2)c1[N+](=O)[O-] 584577835 JFFFXHJVQLPWIT-UHFFFAOYSA-N 231.207 2.976 5 40 BFBB CSc1ccc([N+](=O)[O-])cc1C(C)=O 125371 JUSPIIZYFLLBBK-UHFFFAOYSA-N 211.242 2.519 5 40 BFBB c1ccc2c(c1)[nH]c1c2nc2ccccn21 5117514 PFKQNBQQGPVKNR-UHFFFAOYSA-N 207.236 2.969 5 40 BFBB O=[N+]([O-])c1cccc(CSc2ncccn2)c1 5893596 OEMZDCKWLAIGPY-UHFFFAOYSA-N 247.279 2.677 5 40 BFBB O=[N+]([O-])c1ccc(-c2ccccc2)cc1O 36127397 HYPKGPVDQYUOSV-UHFFFAOYSA-N 215.208 2.967 5 40 BFBB Cc1c(C(C)C)[nH]c2cccc([N+](=O)[O-])c2c1=O 685937944 CLNRLHNSGQFVTA-UHFFFAOYSA-N 246.266 2.868 5 40 BFBB CC(F)(F)COc1cccc([N+](=O)[O-])c1 1083811665 AGXGPGZRXPLQLM-UHFFFAOYSA-N 217.171 2.629 5 40 BFBB Cc1cc(-c2ccc(CO)o2)c([N+](=O)[O-])cc1C 70461247 JKLVDIIDSSHSMN-UHFFFAOYSA-N 247.250 2.964 5 40 BFBB C[N+](C)(C)[C@@]12CCCCC[C@H]1SC2 5574531 BJUOZXBHRNHPCL-GHMZBOCLSA-N 200.371 2.511 5 40 BFBB O=[N+]([O-])c1c(F)cccc1OC(F)(F)Cl 95215647 UKFKRLOATYZXHB-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB O=[N+]([O-])c1cc(F)cc(Cl)c1OC(F)F 95215740 WBLYZMVYCRRMLR-UHFFFAOYSA-N 241.552 2.989 5 40 BFBB CCc1ccc(NC(=O)C2CC2)cc1[N+](=O)[O-] 32796315 ZAGGXPDQJMOAGG-UHFFFAOYSA-N 234.255 2.506 5 40 BFBB CN(Cc1ccccc1)c1ncccc1[N+](=O)[O-] 65554819 NCWDGZCMLBIBJE-UHFFFAOYSA-N 243.266 2.626 5 40 BFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)C(C)(C)C 5362130 ODXSASFYKQUPFL-UHFFFAOYSA-N 236.271 2.888 5 40 BFBB O=Cc1ccc(-c2ccc(F)cc2[N+](=O)[O-])o1 8732335 LWKSPHVQUQUBEX-UHFFFAOYSA-N 235.170 2.806 5 40 BFBB CCOC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C 35333588 OUPCDOPMMAJMMR-UHFFFAOYSA-N 237.255 2.697 5 40 BFBB in-vitro O=Cc1cc2cccnc2c2ncccc12 85210715 YKZOGTMQUSLNBU-UHFFFAOYSA-N 208.220 2.596 5 40 BFBB CC[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1F 4524538 AKTNGEYIAZOWHJ-SSDOTTSWSA-N 240.234 2.719 5 40 BFBB O=[N+]([O-])c1cccc(/C=C/c2ccncn2)c1 195547704 ZMLAJRLATCAJEH-SNAWJCMRSA-N 227.223 2.555 5 40 BFBB Cc1cc([N+](=O)[O-])cc(C(C)(C)C)c1O 19801424 NRKMKBXQEOBAKP-UHFFFAOYSA-N 209.245 2.906 5 40 BFBB CCCC(=O)Nc1cccc([N+](=O)[O-])c1C 491998 HWKIDNRTYXPRLX-UHFFFAOYSA-N 222.244 2.642 5 40 BFBB O=[N+]([O-])c1cc(F)c(Cl)cc1OC(F)F 95215466 JJFMNQSXUCTYQF-UHFFFAOYSA-N 241.552 2.989 5 40 BFBB O=[N+]([O-])c1ccc(NP2(=O)CC=CC2)cc1 8379082 HLAXJLDWZZVTBJ-UHFFFAOYSA-N 238.183 2.855 5 40 BFBB CC(=O)Nc1ccc(C(F)(F)F)c([N+](=O)[O-])c1 3168150 PAEOCGFSTKGDJB-UHFFFAOYSA-N 248.160 2.572 5 40 BFBB Cc1ccnc(C(=O)c2cccc([N+](=O)[O-])c2)c1 5344036 YWZIHTBTUKEGLG-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB CC(C)(C)CC(=O)Nc1cccc([N+](=O)[O-])c1 5496181 QOZZPIVJLPSPCC-UHFFFAOYSA-N 236.271 2.970 5 40 BFBB O=[N+]([O-])c1ccccc1C1N=NC(=S)N=N1 27027736 ZOLOCTAKWXXGLW-UHFFFAOYSA-N 235.228 2.796 5 40 BFBB Cc1n[nH]c(C)c1CNc1ccccc1[N+](=O)[O-] 37059027 OFGVPZNLLOYKCR-UHFFFAOYSA-N 246.270 2.547 5 40 BFBB Cc1cnn(-c2ccc([N+](=O)[O-])cc2Cl)c1 35655576 OIQRWYOKOGRJAU-UHFFFAOYSA-N 237.646 2.742 5 40 BFBB CC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F 169801723 LCXRHTVTVGRVAK-UHFFFAOYSA-N 233.145 2.816 5 40 BFBB O=[N+]([O-])c1cccnc1NCCc1cccs1 18247498 WFSQPHYYOVWNHT-UHFFFAOYSA-N 249.295 2.706 5 40 BFBB C[N+]1([C@@H]2CC[C@H]3CCC[C@@H]2[C@H]3O)CCCCC1 13777479 IMXNJBZKYVFTKA-BARDWOONSA-N 238.395 2.557 5 40 BFBB Cc1cc([N+](=O)[O-])c(N)c(Cl)c1Cl 70461516 PUYJRNDNCKNRGN-UHFFFAOYSA-N 221.043 2.792 5 40 BFBB Cc1nc(Cl)c(Cl)cc1[N+](=O)[O-] 225740078 YLSJKTLFQQKWJM-UHFFFAOYSA-N 207.016 2.605 5 40 BFBB CC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 34507759 LTISRGFPIRUMBT-UHFFFAOYSA-N 248.282 2.788 5 40 BFBB Cc1ccc([C@H](O)c2cccc([N+](=O)[O-])c2)cc1 226291398 MWPUENMZTBDUPE-AWEZNQCLSA-N 243.262 2.985 5 40 BFBB Cc1cc(Cl)c2c([N+](=O)[O-])c(O)ccc2n1 338314 MQONWPXSCSKAJG-UHFFFAOYSA-N 238.630 2.810 5 40 BFBB CC(=O)c1sc2cccc([N+](=O)[O-])c2c1N 339072 DLAOSUYBSRKDGD-UHFFFAOYSA-N 236.252 2.594 5 40 BFBB O=c1ccc2nc3ccccc3sc-2c1 5519645 YKGCCFHSXQHWIG-UHFFFAOYSA-N 213.261 2.761 5 40 BFBB O=[N+]([O-])c1cccc2cnc(Cl)cc12 40448378 NPORMNSYOVFNQW-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB CCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 4179473 QBZIBYDDYQPNJR-UHFFFAOYSA-N 228.635 2.597 5 40 BFBB O=C(c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 2392561 AOHVHRTYAQSPFQ-UHFFFAOYSA-N 245.209 2.965 5 40 BFBB O=[N+]([O-])[C@@H]1CC[C@H]2CC[C@@H]3CCC[C@@H]1[C@H]32 5328132 WUTRGTKNJPEJDE-RNWYCLNJSA-N 209.289 2.868 5 40 BFBB O=[N+]([O-])c1cccc(F)c1CC(F)(F)F 1083802430 WIDSINSVXWZAQT-UHFFFAOYSA-N 223.125 2.839 5 40 BFBB CC(=O)CSCc1c(F)cccc1[N+](=O)[O-] 81273769 LMRPCIOBOGJDGV-UHFFFAOYSA-N 243.259 2.556 5 40 BFBB O=[N+]([O-])c1ccc(N2CCCCCCC2)nc1 58003435 LLGTXUICTOSPAA-UHFFFAOYSA-N 235.287 2.760 5 40 BFBB O=[N+]([O-])c1ccc(-c2cccc(O)c2)cc1 2539986 KYLNRUUIOCCZPG-UHFFFAOYSA-N 215.208 2.967 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)[C@H]1CCC[S@]1(=O)=N2 1503350581 AHYHABFBFRUJGU-QLJPJBMISA-N 238.268 2.543 5 40 BFBB O=[N+]([O-])c1cccc(-c2ncc3ccccn23)c1 126044 JOTGZHHDHITSSG-UHFFFAOYSA-N 239.234 2.910 5 40 BFBB O=[N+]([O-])c1ccccc1/C=C/Br 34528654 KJTHFXBQENAJML-AATRIKPKSA-N 228.045 2.960 5 40 BFBB CC(C)n1cc([N+](=O)[O-])c(NC2CCCC2)n1 95098503 YZFFWBOZAZLSQP-UHFFFAOYSA-N 238.291 2.727 5 40 BFBB O=C(OCc1ccco1)c1ccc([N+](=O)[O-])cc1 1506896 NBGFOLAMLIIQHO-UHFFFAOYSA-N 247.206 2.545 5 40 BFBB Cn1c(=S)[nH]c2cc3ccccc3cc2c1=O 5265078 WPPUJQZCOIHRRL-UHFFFAOYSA-N 242.303 2.749 5 40 BFBB O=[N+]([O-])c1ccccc1-c1c[nH]c(=S)o1 199791915 LIORXIAFYQPLLK-UHFFFAOYSA-N 222.225 2.912 5 40 BFBB Cc1noc(/C=C\c2ccc(O)cc2)c1[N+](=O)[O-] 408543304 OSOGTJIKSULDJI-DAXSKMNVSA-N 246.222 2.767 5 40 BFBB Cc1cncc(NCc2cccc([N+](=O)[O-])c2)c1 95430909 RMIHVMSANPFBAQ-UHFFFAOYSA-N 243.266 2.910 5 40 BFBB C[n+]1cccc2ccc3ccc(Cl)nc3c21 116356956 ZZTSXGIDFNKYNJ-UHFFFAOYSA-N 229.690 2.866 5 40 BFBB O=[N+]([O-])c1cnc2ccsc2c1Cl 34247885 RKZKGVJIROTNKJ-UHFFFAOYSA-N 214.633 2.858 5 40 BFBB O=[N+]([O-])c1cccc(OC(F)(F)Cl)c1 95215547 JMGXSACEFMFDMU-UHFFFAOYSA-N 223.562 2.763 5 40 BFBB CN(C)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 96316050 GOMANHCYDFXGTD-UHFFFAOYSA-N 222.288 2.958 5 40 BFBB CCc1cc(Cl)c(NC(C)=O)c([N+](=O)[O-])c1 216732970 NRBAKOJXDXYAQV-UHFFFAOYSA-N 242.662 2.769 5 40 BFBB O=[N+]([O-])c1ccc(-c2nnc(Cl)s2)cc1 38977248 ZXKJMLDGQDSMJP-UHFFFAOYSA-N 241.659 2.767 5 40 BFBB O=[N+]([O-])c1ccc(NC[C@@H]2CCC=CO2)cc1 50268564 ZPGTVDFZHMXGNP-LBPRGKRZSA-N 234.255 2.699 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1OCC1CC1 95347574 LHXIEYMQIBVUOA-UHFFFAOYSA-N 211.192 2.523 5 40 BFBB in-vitro CC(=O)Nc1cc([N+](=O)[O-])c2ccccc2c1 96316042 YUEABKOBZGRXMB-UHFFFAOYSA-N 230.223 2.706 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1-n1cccc1 145440 DRWICIPIDZMEPD-UHFFFAOYSA-N 206.176 2.525 5 40 BFBB CCc1cc([N+](=O)[O-])cc(Cl)c1N(C)C 226315905 FXHXCBMGTOJFJV-UHFFFAOYSA-N 228.679 2.877 5 40 BFBB O=c1ccc2nc3ccccc3ccc-2c1 1713704 CVKDTTCYQAJIAC-UHFFFAOYSA-N 207.232 2.700 5 40 BFBB world COc1cccc2cc([N+](=O)[O-])ccc12 71256621 INFGAEQGJCQVEZ-UHFFFAOYSA-N 203.197 2.757 5 40 BFBB COCCSCCc1ccc([N+](=O)[O-])cc1 95404315 BYKRHRQTVLFAQH-UHFFFAOYSA-N 241.312 2.517 5 40 BFBB O=C1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] 36405301 WHRFCXKVKLNWAI-JTQLQIEISA-N 219.240 2.507 5 40 BFBB in-vitro CC(C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 4673470 VWIDTCGXIBGZBZ-UHFFFAOYSA-N 242.662 2.843 5 40 BFBB COC(=O)[C@H](C)c1ccc(Cl)c([N+](=O)[O-])c1 59649563 WMUYHRSAYZPLDU-ZCFIWIBFSA-N 243.646 2.525 5 40 BFBB CN(C)/C=C/c1oc2ccc(O)cc2c1[N+](=O)[O-] 59925553 XEULJPQFOBUHGA-AATRIKPKSA-N 248.238 2.579 5 40 BFBB O=Cc1nc(-c2ccccc2[N+](=O)[O-])cs1 61798949 YOPMYMMEQSRMCO-UHFFFAOYSA-N 234.236 2.531 5 40 BFBB O=[N+]([O-])c1ccc(-c2cccc(CO)c2)cc1 199970926 GEBSJKSTANYIJM-UHFFFAOYSA-N 229.235 2.754 5 40 BFBB O=[N+]([O-])c1cccc(CNc2ccccn2)c1 39076620 BYKAUKZVYPFMTK-UHFFFAOYSA-N 229.239 2.602 5 40 BFBB CC(=O)Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-] 4726158 HMZLGAJIRGFBFR-UHFFFAOYSA-N 249.053 2.860 5 40 BFBB CC(C)OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 38327657 DXARYHOQVDCSKB-VMPITWQZSA-N 235.239 2.560 5 40 BFBB CC(C)([C@H](O)c1ccc2ccccc2c1)[N+](=O)[O-] 39257871 SPOVJZNIJBQEQC-CYBMUJFWSA-N 245.278 2.929 5 40 BFBB Cc1ccc(C)n1Nc1ccc([N+](=O)[O-])cc1 59549607 WLEYSAQZBFFOSV-UHFFFAOYSA-N 231.255 2.888 5 40 BFBB CC(=O)Nc1c([N+](=O)[O-])sc2ccccc12 4154601 JNZWBPRGTXNLDI-UHFFFAOYSA-N 236.252 2.768 5 40 BFBB CC(=O)OCCC/C(=C/c1ccccc1)[N+](=O)[O-] 5431856 VLJSJHMJSBHITE-RAXLEYEMSA-N 249.266 2.648 5 40 BFBB CCCNc1c([N+](=O)[O-])c(=O)oc2ccccc12 3895928 MIQDOFUCSXHPAX-UHFFFAOYSA-N 248.238 2.523 5 40 BFBB CCC(=O)Nc1c(C)cc([N+](=O)[O-])cc1CC 45888180 QQOBYQYGECZJFG-UHFFFAOYSA-N 236.271 2.814 5 40 BFBB N[C@H](CO)c1c2ccccc2cc2ccccc12 72198834 ZNTMTJISNMWNMS-OAHLLOKOSA-N 237.302 2.985 5 40 BFBB O=[N+]([O-])c1ccc(Oc2ccccc2)cn1 165234922 XUBRRDQSHJQLBR-UHFFFAOYSA-N 216.196 2.782 5 40 BFBB CS[C@@H](C)CNc1ccc([N+](=O)[O-])cc1 91504346 XJORMVYGRGIXNF-QMMMGPOBSA-N 226.301 2.758 5 40 BFBB C[n+]1cc2cc3c(cc2c2ccccc21)OCO3 1561149 NNDVWZDEHOEGAJ-UHFFFAOYSA-N 238.266 2.546 5 40 BFBB CN(C)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4158474 NUOLTZCFCVFMFT-UHFFFAOYSA-N 249.192 2.502 5 40 BFBB CC(C)COc1c(C=O)cc(F)cc1[N+](=O)[O-] 225271260 GDDQCPKLLMGSPG-UHFFFAOYSA-N 241.218 2.581 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1OCc1cccnc1 72336332 RLHIGORQJFLNFF-UHFFFAOYSA-N 248.213 2.708 5 40 BFBB Cc1cc([N+](=O)[O-])sc1Br 36379638 ILEZTVGLBNABDK-UHFFFAOYSA-N 222.063 2.727 5 40 BFBB in-vitro O=C1CCCCc2ccc([N+](=O)[O-])cc21 5699687 VDNGDQXLGGSHHT-UHFFFAOYSA-N 205.213 2.504 5 40 BFBB in-vitro Cc1ccc([C@](C)(O)C(F)(F)F)cc1[N+](=O)[O-] 43368069 SEHNLXPTGZIGIP-VIFPVBQESA-N 249.188 2.673 5 40 BFBB CC(C)NCc1cc(Cl)ccc1[N+](=O)[O-] 82829128 NCGHWRAULOAMHD-UHFFFAOYSA-N 228.679 2.746 5 40 BFBB O=[N+]([O-])c1ccc(N2CCc3ccccc32)nc1 14807948 RCNVHXDTXXLRQB-UHFFFAOYSA-N 241.250 2.684 5 40 BFBB Cc1ccc(Nc2c([N+](=O)[O-])ncn2C)cc1C 4729593 FVQJFFALPVJVDA-UHFFFAOYSA-N 246.270 2.689 5 40 BFBB Cc1cc([C@@H](O)c2ccccc2)ccc1[N+](=O)[O-] 226293096 BWRGTXLRXNXZNG-AWEZNQCLSA-N 243.262 2.985 5 40 BFBB CC[N+]1(CC)CC2=C(Cl)C=CC[C@H]2C1 346426 OTVVECHGCQHNPK-JTQLQIEISA-N 212.744 2.926 5 40 BFBB CCCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 44676182 ICOMSZKQJHRRCL-UHFFFAOYSA-N 233.227 2.597 5 40 BFBB COc1ccc(C(F)F)c([N+](=O)[O-])c1 238355804 LHRSRHDVYFCMPL-UHFFFAOYSA-N 203.144 2.541 5 40 BFBB CC(=O)Nc1cc([N+](=O)[O-])cc2ccccc12 345655 MQLMDPUDIBLYMT-UHFFFAOYSA-N 230.223 2.706 5 40 BFBB CCCCCC1(C)OCC(CC)([N+](=O)[O-])CO1 1682255 PKZFKNXCDCEJCG-UHFFFAOYSA-N 245.319 2.755 5 40 BFBB C/N=c1\ccc2nc3ccc(N)cc3sc-2c1 5187389 QFYWEMZCVYRHJE-OQLLNIDSSA-N 241.319 2.514 5 40 BFBB O=[N+]([O-])c1cccc(F)c1OC(F)(F)F 95215585 MGMDQAYSTPSOMM-UHFFFAOYSA-N 225.097 2.633 5 40 BFBB O=c1c2ccccc2oc2c(O)cccc12 4128067 KBQFPPUAIJHDCO-UHFFFAOYSA-N 212.204 2.652 5 40 BFBB endogenous,in-man O=Cc1ccnc2c1ccc1cccnc12 34345328 DBLDVGMUYWAEMK-UHFFFAOYSA-N 208.220 2.596 5 40 BFBB CC[C@H](C)Nc1ccc(C(=O)O)cc1[N+](=O)[O-] 13276763 DQBNOZHZXARJLB-ZETCQYMHSA-N 238.243 2.503 5 40 BFBB Cc1ccc([N+](=O)[O-])c(OCC(F)F)c1 72209401 ZFBYCUBTYLACTN-UHFFFAOYSA-N 217.171 2.547 5 40 BFBB c1ccc2c(c1)[nH]c1nc3ccncc3nc12 16982860 LTZXULZURZEGKZ-UHFFFAOYSA-N 220.235 2.659 5 40 BFBB O=[N+]([O-])c1ccc2c([N+](=O)[O-])ccc3c2c1CC3 1727961 WFTCCZBXYNRNNA-UHFFFAOYSA-N 244.206 2.755 5 40 BFBB O=[N+]([O-])c1ccc(Oc2ccccn2)cc1 36460050 FQAYGCIUSYYCSF-UHFFFAOYSA-N 216.196 2.782 5 40 BFBB O=[N+]([O-])c1ccc(CNc2ccncc2F)cc1 192149768 FISHBXZSTMSJKX-UHFFFAOYSA-N 247.229 2.741 5 40 BFBB CC/C(=C\c1ccc(OC)c(OC)c1)[N+](=O)[O-] 4748085 NRBCNHBQBWHAJU-JXMROGBWSA-N 237.255 2.731 5 40 BFBB COC(=O)c1ccc(-c2ccccc2[N+](=O)[O-])o1 21988909 XAAWIYOZXZGYGD-UHFFFAOYSA-N 247.206 2.641 5 40 BFBB O=[N+]([O-])c1ccc(/C=C\c2csnn2)cc1 17196763 STAYCBUZFVGGLZ-RJRFIUFISA-N 233.252 2.617 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1Sc1ncc[nH]1 39424384 VXHBPGNVRYDXGK-UHFFFAOYSA-N 239.231 2.608 5 40 BFBB CC[C@@](O)(c1cccc([N+](=O)[O-])c1)C(F)(F)F 43368182 NQAROGWFJFQXPU-SECBINFHSA-N 249.188 2.755 5 40 BFBB COc1ccc(Oc2ncccc2[N+](=O)[O-])cc1 132647 RRWDAVSBLSUVEI-UHFFFAOYSA-N 246.222 2.791 5 40 BFBB O=[N+]([O-])c1cc(Cl)c([N+](=O)[O-])c(Cl)c1 33505928 YXGARXWBFZIFBC-UHFFFAOYSA-N 236.998 2.810 5 40 BFBB O=[N+]([O-])c1ccc(F)c(CC(F)(F)F)c1 66323297 GIKRGEUVGUHLTQ-UHFFFAOYSA-N 223.125 2.839 5 40 BFBB Cn1c(=O)c2ccccc2n2cc3ccccc3c12 1506469 AZCKQYSBRWHJDZ-UHFFFAOYSA-N 248.285 2.944 5 40 BFBB O=C1c2ccccc2-c2cccc([N+](=O)[O-])c21 1701536 VDFKURANQKCOAI-UHFFFAOYSA-N 225.203 2.806 5 40 BFBB C[C@@H]1C[C@@H]1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 20064299 VSRXWIQZKKUECL-MUWHJKNJSA-N 222.200 2.626 5 40 BFBB CCc1cc([N+](=O)[O-])c(C)nc1Cl 98086071 WGIKJJHSOXBQQZ-UHFFFAOYSA-N 200.625 2.514 5 40 BFBB CC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 17004630 SKACCCDFHQZGIA-UHFFFAOYSA-N 230.223 2.706 5 40 BFBB Cc1cc(Oc2cccc(C)c2[N+](=O)[O-])ncn1 95974616 XZSLMSDCINROAV-UHFFFAOYSA-N 245.238 2.794 5 40 BFBB Nc1cccc2c1-c1ccc([N+](=O)[O-])cc1C2 1705940 ASWMPVHYZUZAEN-UHFFFAOYSA-N 226.235 2.748 5 40 BFBB C[C@@H](Cc1ccco1)Nc1ncccc1[N+](=O)[O-] 25575564 CAXDYDANWZRRCA-VIFPVBQESA-N 247.254 2.626 5 40 BFBB COc1ccc2nc3cc(OC)ccc3nc2c1 3843429 RPAJPBQTMCLQME-UHFFFAOYSA-N 240.262 2.800 5 40 BFBB biogenic O=[N+]([O-])[C@H]1[C@H]2CC[C@@H](C2)[C@H]1c1ccccc1 100170123 XLJNFVWRSYMVKN-RVMXOQNASA-N 217.268 2.845 5 40 BFBB O=C(c1ccc([N+](=O)[O-])cc1)c1ccccc1F 347319 LCVWICCHGJHKEX-UHFFFAOYSA-N 245.209 2.965 5 40 BFBB O=[N+]([O-])c1ccccc1[S@](=O)c1ccccc1 6575812 UQDQXWRDAPUTAL-KRWDZBQOSA-N 247.275 2.762 5 40 BFBB O=[N+]([O-])c1c(Cl)ccc2scnc12 32627289 JCWDUKKVPUULOU-UHFFFAOYSA-N 214.633 2.858 5 40 BFBB CCOC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 3163825 NCRGVCUMYXRXJH-UHFFFAOYSA-N 238.243 2.780 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)C(F)(F)OC2(F)F 500597 CJPBREPKGKSNTA-UHFFFAOYSA-N 237.108 2.724 5 40 BFBB Cc1cccc2c1nc1ccccc1[n+]2C 5700936 KHFQFKTXXWPPPN-UHFFFAOYSA-N 209.272 2.521 5 40 BFBB Cc1ccc2c([N+](=O)[O-])cc(C)c(F)c2n1 85399642 XVBWKQIQXMKNPR-UHFFFAOYSA-N 220.203 2.899 5 40 BFBB Cc1[nH]c2cccc([N+](=O)[O-])c2c(=O)c1C(C)C 685938249 MZXHWKAPCYOZNQ-UHFFFAOYSA-N 246.266 2.868 5 40 BFBB O=[N+]([O-])c1ccccc1OCc1ccco1 36617317 UBBQCIPTVZKESR-UHFFFAOYSA-N 219.196 2.767 5 40 BFBB Cc1c([N+](=O)[O-])cc(C(C)C)c(O)c1[N+](=O)[O-] 1866979 XBCVBHKJVWVNID-UHFFFAOYSA-N 240.215 2.640 5 40 BFBB O=Cc1cc([N+](=O)[O-])ccc1N1CCCCCC1 9239669 MPXAIDUYLTVOKF-UHFFFAOYSA-N 248.282 2.788 5 40 BFBB O=[N+]([O-])c1cc(-n2ccc3ccccc32)ccn1 98175375 PBMGTCHUKYTHJX-UHFFFAOYSA-N 239.234 2.934 5 40 BFBB O=[N+]([O-])c1ccc(OCc2ccco2)cc1 35655559 DULPRRJPAPIWSA-UHFFFAOYSA-N 219.196 2.767 5 40 BFBB CCOC(=O)c1cc([N+](=O)[O-])cc(Cl)c1F 88121873 IMUGJHIALJNPHB-UHFFFAOYSA-N 247.609 2.564 5 40 BFBB CCCC[N+]1(C)C[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1 104360822 VQUSOYOKYIOOFB-JZAZDWQXSA-N 206.353 2.685 5 40 BFBB COc1cc(-c2ccc(C=O)o2)cc([N+](=O)[O-])c1 8731415 JYSMAFAIWXRIGU-UHFFFAOYSA-N 247.206 2.676 5 40 BFBB CC[C@@H](C)c1cc([N+](=O)[O-])cc(C(=O)O)c1O 35181663 PLXCUBDYRVBVIF-ZCFIWIBFSA-N 239.227 2.512 5 40 BFBB CC(C)(C)Nc1nc2ccc([N+](=O)[O-])cc2o1 520140 OWKMZBHWVPETHV-UHFFFAOYSA-N 235.243 2.946 5 40 BFBB C[N+](C)(C)CCC(=O)c1ccc(Cl)cc1 1571869 POJUJVPUWRSFLL-UHFFFAOYSA-N 226.727 2.619 5 40 BFBB Cc1ccc([N+](=O)[O-])c(NC(=O)C2CC2)c1C 6282306 HIGAUIKTQFZBRT-UHFFFAOYSA-N 234.255 2.560 5 40 BFBB CCC(=O)COc1ccc(CC)cc1[N+](=O)[O-] 70497908 OSRNYLCWXONRIW-UHFFFAOYSA-N 237.255 2.515 5 40 BFBB CCC[C@@]1([N+](C)(C)C)CS[C@@H]1CC 1873895 DBTVVWUOYRIQLT-GHMZBOCLSA-N 202.387 2.757 5 40 BFBB COc1cccc2oc3c(O)cccc3c(=O)c12 6485079 GCAMSSLNXVYMKS-UHFFFAOYSA-N 242.230 2.660 5 40 BFBB biogenic,in-vitro C[N+]1(C)C[C@H]2C(Cl)=C(Cl)CC[C@H]2C1 494848 JIIWFHHPAIWXFI-JGVFFNPUSA-N 221.151 2.792 5 40 BFBB CC(C)(C)Nc1ccc([N+](=O)[O-])cc1C(=O)O 19844566 ZODCDNLBRXJWPQ-UHFFFAOYSA-N 238.243 2.503 5 40 BFBB CC[C@H](C)c1cc([N+](=O)[O-])cc(C(=O)O)c1O 35181665 PLXCUBDYRVBVIF-LURJTMIESA-N 239.227 2.512 5 40 BFBB CN(c1ccccc1)c1ccc([N+](=O)[O-])cn1 96361315 MLGZSRHNPOHAJX-UHFFFAOYSA-N 229.239 2.758 5 40 BFBB Cc1cc(C(=O)NC2CCCC2)ccc1[N+](=O)[O-] 3448894 ZSFNZFGMLATSKN-UHFFFAOYSA-N 248.282 2.576 5 40 BFBB CC(C)(C)C(=O)Nc1ccc([N+](=O)[O-])cc1 5726573 HSZJUXSRDNASMQ-UHFFFAOYSA-N 222.244 2.579 5 40 BFBB Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)co1 12446003 RTCROUPPHPFDRV-UHFFFAOYSA-N 246.222 2.749 5 40 BFBB CC(=O)c1ccc(NCC(C)C)c([N+](=O)[O-])c1 67949647 JLMWZTOCGMBQSZ-UHFFFAOYSA-N 236.271 2.865 5 40 BFBB C=C(Br)c1ccc([N+](=O)[O-])cc1 160272 ZFZQVVWJEJOWQF-UHFFFAOYSA-N 228.045 2.960 5 40 BFBB Cc1ccc2cccc([N+](=O)[O-])c2c1[N+](=O)[O-] 1665388 DXVXSQSYZFSSET-UHFFFAOYSA-N 232.195 2.965 5 40 BFBB O=c1c2ccccc2sc2ncccc12 346758 VEOSCXKPFWPNIA-UHFFFAOYSA-N 213.261 2.810 5 40 BFBB biogenic CCCCCNCc1cccc([N+](=O)[O-])c1 5973234 DEHPRFDGWMBMFJ-UHFFFAOYSA-N 222.288 2.875 5 40 BFBB O=[N+]([O-])c1cccc(-c2nnc(Cl)s2)c1 34458228 SBLPQMINRAUSHC-UHFFFAOYSA-N 241.659 2.767 5 40 BFBB CNCc1cccc2nc3ccccc3nc12 85391012 KLPNSHOGNBQUFP-UHFFFAOYSA-N 223.279 2.502 5 40 BFBB Cc1ccc2ccc(F)c([N+](=O)[O-])c2n1 85399515 SBJULPHNMKTOGN-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB O=[N+]([O-])c1ccc(F)c(OC(F)(F)F)c1 95215599 MKFPPICVTBQONY-UHFFFAOYSA-N 225.097 2.633 5 40 BFBB C[C@@H]1N(C)c2cc([N+](=O)[O-])ccc2C1(C)C 1577972 BYHFGPIICGZZNB-QMMMGPOBSA-N 220.272 2.711 5 40 BFBB CCc1ccc(NC(=O)[C@@H]2C[C@H]2C)cc1[N+](=O)[O-] 27317788 OZISJYPFMKWAJP-LDYMZIIASA-N 248.282 2.752 5 40 BFBB Cc1cccnc1C(=O)c1cccc([N+](=O)[O-])c1 45028673 LMLSHQXBLRKONC-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB O=[N+]([O-])c1cccnc1Oc1cccc(F)c1 57681817 XBXAWLOLNKREED-UHFFFAOYSA-N 234.186 2.921 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)[C@@H]1CCC[S@@]1(=O)=N2 1503350578 AHYHABFBFRUJGU-QFYYESIMSA-N 238.268 2.543 5 40 BFBB Cc1nc(-c2ccc([N+](=O)[O-])cc2)co1 39320807 ZAKPWXYZFABNMV-UHFFFAOYSA-N 204.185 2.558 5 40 BFBB CCOc1ccc(Br)c([N+](=O)[O-])c1 70461203 NBQGLPWODFWUDQ-UHFFFAOYSA-N 246.060 2.756 5 40 BFBB O=Cc1c([N+](=O)[O-])ccc2ccccc12 13547544 RBNOOAYOTXDPKR-UHFFFAOYSA-N 201.181 2.561 5 40 BFBB CCSCC(=O)c1ccc([N+](=O)[O-])cc1 37353240 IGXNTABRYODQHW-UHFFFAOYSA-N 225.269 2.531 5 40 BFBB CN(Cc1c(F)cccc1[N+](=O)[O-])CC1CC1 89350754 RVHZLWLQRNRJSQ-UHFFFAOYSA-N 238.262 2.576 5 40 BFBB CCCC(=O)Nc1c(C)cc([N+](=O)[O-])cc1C 45888189 AAWZLRGFLIIGLD-UHFFFAOYSA-N 236.271 2.950 5 40 BFBB CCOSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1680480 DLRZXVDHDJBCRN-UHFFFAOYSA-N 244.228 2.547 5 40 BFBB O=[N+]([O-])c1ccc(-c2cnc3ccccn23)cc1 13220274 ZNTPEAGAMIBSKF-UHFFFAOYSA-N 239.234 2.910 5 40 BFBB CCCC[N+]1(C)C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2C1 104360825 VQUSOYOKYIOOFB-XUXIUFHCSA-N 206.353 2.685 5 40 BFBB CCn1cc(/C=C/[N+](=O)[O-])c2ccccc21 794899 SAXPNASNQGXAJV-BQYQJAHWSA-N 216.240 2.909 5 40 BFBB O=[N+]([O-])c1ccccc1NC1CCCC1 19998978 ZQLZSKZOTVXWNW-UHFFFAOYSA-N 206.245 2.949 5 40 BFBB in-vitro O=[N+]([O-])c1cnccc1NCc1ccccc1 20370229 MEVVLVNFFGTNKY-UHFFFAOYSA-N 229.239 2.602 5 40 BFBB in-vitro Cc1ccccc1CNc1ccc([N+](=O)[O-])cn1 22132263 UPSRSELRPVOGTE-UHFFFAOYSA-N 243.266 2.910 5 40 BFBB Cc1c2ccc(=O)cc-2oc2cc(O)ccc12 4582278 SVRLBYNUPKWESW-UHFFFAOYSA-N 226.231 2.912 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)[C@@H](O)c1ccccc1-2 900550 ZUXWEWNCAHRWBV-ZDUSSCGKSA-N 227.219 2.657 5 40 BFBB in-vitro CCN(CC)c1ccc([N+](=O)[O-])cc1C 35962581 HSCVEDHMFBCUQI-UHFFFAOYSA-N 208.261 2.749 5 40 BFBB O=[N+]([O-])c1ccc(OC(F)(F)F)cc1F 34303432 QQRLTSAICSXWBE-UHFFFAOYSA-N 225.097 2.633 5 40 BFBB in-vitro O=C(c1cccc([N+](=O)[O-])c1)c1cccs1 1600012 KMSMPSLCVVLOQF-UHFFFAOYSA-N 233.248 2.887 5 40 BFBB O=[N+]([O-])[C@@H]1CC[C@H]2CC[C@H]3CCC[C@@H]1[C@H]32 5328131 WUTRGTKNJPEJDE-RMPHRYRLSA-N 209.289 2.868 5 40 BFBB O=Cc1cc2cc([N+](=O)[O-])ccc2s1 39391885 MYNRFEHVTRVGTK-UHFFFAOYSA-N 207.210 2.622 5 40 BFBB Cc1ccc2nc3ccc(Cl)cc3[n+]([O-])c2c1 4277111 YSNZDNHACBZCOU-UHFFFAOYSA-N 244.681 2.983 5 40 BFBB O=[N+]([O-])c1ccc2nc(-c3cccnc3)oc2c1 73640092 LOCODLYEBPXDNE-UHFFFAOYSA-N 241.206 2.798 5 40 BFBB CSc1cc(N)c([N+](=O)[O-])cc1Cl 144202159 LRLUAADJKCMBSB-UHFFFAOYSA-N 218.665 2.552 5 40 BFBB CCCCCNC(=O)c1cccc([N+](=O)[O-])c1 1599306 PTYQIRDYNKNNMG-UHFFFAOYSA-N 236.271 2.515 5 40 BFBB CCCCC(=O)Nc1ccc(F)c([N+](=O)[O-])c1 2064506 AJNYEMLGBXCAJD-UHFFFAOYSA-N 240.234 2.863 5 40 BFBB CC(=N)Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4066887 XCDUBMCJYHILAH-UHFFFAOYSA-N 241.228 2.592 5 40 BFBB C[C@H](Cn1ccc([N+](=O)[O-])n1)c1ccccc1 71978611 FSNNCOFVHBBNNF-SNVBAGLBSA-N 231.255 2.595 5 40 BFBB Cc1ccc(Sc2c([N+](=O)[O-])ncn2C)cc1 480490 XGLPUNTVRWMETB-UHFFFAOYSA-N 249.295 2.788 5 40 BFBB CC/C(=C/c1ccc(OC)cc1OC)[N+](=O)[O-] 1592092 PQMRXWZJELZJOC-YFHOEESVSA-N 237.255 2.731 5 40 BFBB CC(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1F 4524502 LEFWMWYOKIIBAC-UHFFFAOYSA-N 240.234 2.719 5 40 BFBB Cc1ccncc1C(=O)c1ccc([N+](=O)[O-])cc1 45029010 SIHPNTYNWJVJEO-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB O=[N+]([O-])c1cccc(N2CCCCCC2)c1 90367572 GZIFTZLAJWUXMD-UHFFFAOYSA-N 220.272 2.975 5 40 BFBB CCCCCOC(=O)c1cccc([N+](=O)[O-])c1 1669866 XBIHYUDQJSHAIJ-UHFFFAOYSA-N 237.255 2.942 5 40 BFBB biogenic CCC[C@H](C)NC(=O)c1csc([N+](=O)[O-])c1 42567361 JNZVUADIOWYBMP-ZETCQYMHSA-N 242.300 2.575 5 40 BFBB CC(=O)N(C)c1ccc([N+](=O)[O-])c2ccccc12 4127898 FRMGOIUTUNJRNC-UHFFFAOYSA-N 244.250 2.731 5 40 BFBB NNc1nc2ccccc2c2ccccc12 265889 VODJTROQLRJXHY-UHFFFAOYSA-N 209.252 2.674 5 40 BFBB O=[N+]([O-])c1ccc(-c2cccs2)nc1 146740242 FYMUFVAFFXLGKY-UHFFFAOYSA-N 206.226 2.718 5 40 BFBB CCC[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 5794031 YDEDJKADUVKMAE-VIFPVBQESA-N 236.271 2.513 5 40 BFBB CC[C@@]1(C)CC(=O)c2cc([N+](=O)[O-])ccc2O1 12649827 RTWGROIZFAOGSB-LBPRGKRZSA-N 235.239 2.729 5 40 BFBB O=[N+]([O-])c1ccc(C(F)(F)F)cc1S 196060165 WVDVTEDRGYZSQV-UHFFFAOYSA-N 223.175 2.902 5 40 BFBB CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 49531850 LDAPHONQUYLURU-UHFFFAOYSA-N 232.239 2.574 5 40 BFBB CCc1nc2cc([N+](=O)[O-])ccc2s1 85554824 WYDMRFAQEKUVLI-UHFFFAOYSA-N 208.242 2.767 5 40 BFBB CCNc1ccc([N+](=O)[O-])c2ncccc12 9594012 LVQUMNJRPUTDFE-UHFFFAOYSA-N 217.228 2.575 5 40 BFBB O=[N+]([O-])c1cc(F)c(F)cc1C(F)(F)F 66323301 SRBJJMLYCCGXES-UHFFFAOYSA-N 227.088 2.892 5 40 BFBB CCCC(C)(C)c1cc(N)c(O)c([N+](=O)[O-])c1 26893784 OTGMZOJLXXCKBG-UHFFFAOYSA-N 238.287 2.960 5 40 BFBB COC(=O)c1ccc([N+](=O)[O-])c2ccccc12 345644 SJASDMCQHWUAPP-UHFFFAOYSA-N 231.207 2.535 5 40 BFBB O=[N+]([O-])c1ccc(-c2nc3c(o2)CCC3)cc1 1755806 PZWHPCNUNIQFEO-UHFFFAOYSA-N 230.223 2.739 5 40 BFBB O=[N+]([O-])[C@H]1CCCC[C@@H]1c1ccccc1 1556181 JPUJWHOKGSAARG-NEPJUHHUSA-N 205.257 2.990 5 40 BFBB Cc1oc2c([N+](=O)[O-])cccc2c1[N+](=O)[O-] 4962428 JYUWGJZYTXVFAC-UHFFFAOYSA-N 222.156 2.558 5 40 BFBB C[N+](C)(C)[C@]12CCCCC[C@@H]1SC2 1873902 BJUOZXBHRNHPCL-QWRGUYRKSA-N 200.371 2.511 5 40 BFBB Cc1ccc2c([N+](=O)[O-])c(F)cc(C)c2n1 85399657 KUSFOGDOOZXKCB-UHFFFAOYSA-N 220.203 2.899 5 40 BFBB C[N+](C)(C)CCCCCCCC[N+](C)(C)C 1730255 XDZILQXNIZCEDV-UHFFFAOYSA-N 230.440 2.739 5 40 BFBB OCc1c2ccccc2nc2ccccc12 4773978 YUZUPQZNFZWBSR-UHFFFAOYSA-N 209.248 2.880 5 40 BFBB Cc1cc(NC(=O)C(C)C)c([N+](=O)[O-])cc1C 5003622 OOMRYSVDNCXNFX-UHFFFAOYSA-N 236.271 2.806 5 40 BFBB CCOCc1cc([N+](=O)[O-])ccc1Cl 37403948 GRDHFVSQXHJUAY-UHFFFAOYSA-N 215.636 2.785 5 40 BFBB in-vitro O=[N+]([O-])c1ccc(-c2cc3c(o2)CCNC3)cc1 91294556 BJWRBNQRMCWLBU-UHFFFAOYSA-N 244.250 2.501 5 40 BFBB CCCC(=O)Nc1cc([N+](=O)[O-])ccc1C 492000 DUBMBIYGBOKVQM-UHFFFAOYSA-N 222.244 2.642 5 40 BFBB Nc1cccc2c1Cc1cc([N+](=O)[O-])ccc1-2 1570212 MDJSMOFUBKLREW-UHFFFAOYSA-N 226.235 2.748 5 40 BFBB O=[N+]([O-])c1cccc(Br)c1CF 1563591726 RRWGKSHOIHAFPG-UHFFFAOYSA-N 234.024 2.827 5 40 BFBB CC(=O)Nc1ccc2ccc([N+](=O)[O-])cc2c1 345654 OYZYDMWYBZTGKN-UHFFFAOYSA-N 230.223 2.706 5 40 BFBB CC[N+](CC)(CC)CC[N+](CC)(CC)CC 1762539 YUFDHZDLJFUAPC-UHFFFAOYSA-N 230.440 2.739 5 40 BFBB O=[N+]([O-])c1cccc(F)c1OCC(F)(F)F 169800299 PFCLTDLUPKQDTE-UHFFFAOYSA-N 239.124 2.675 5 40 BFBB Nc1ccc2[nH]c(=O)c3cc(Cl)ccc3c2c1 8627884 CBDFLCDZPOWADC-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB C[N+]1([C@H]2CC[C@H]3CCC[C@@H]2[C@H]3O)CCCCC1 13777481 IMXNJBZKYVFTKA-QPSCCSFWSA-N 238.395 2.557 5 40 BFBB O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccco1 521964 AKKNXFZXXQVRLX-UHFFFAOYSA-N 247.206 2.545 5 40 BFBB Cc1cc(-c2nc(C=O)cs2)ccc1[N+](=O)[O-] 90669486 SYCKURTXMKRUTR-UHFFFAOYSA-N 248.263 2.839 5 40 BFBB C/C(Br)=C/c1ccc([N+](=O)[O-])o1 162117 HZLSBQZGGWHNLJ-PLNGDYQASA-N 232.033 2.944 5 40 BFBB CCNCc1cccc2nc3ccccc3nc12 85390997 PTCHRYJDKKELKU-UHFFFAOYSA-N 237.306 2.893 5 40 BFBB CC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1C(=O)O 19844598 SJBHQRYWCGLSEQ-SSDOTTSWSA-N 238.243 2.503 5 40 BFBB O=[N+]([O-])c1ccc(Cl)nc1C(F)(F)F 38540998 KCFXQCGFWFTDPI-UHFFFAOYSA-N 226.541 2.662 5 40 BFBB Cc1ccc2c(C)c([N+](=O)[O-])cnc2c1 256052605 NZKMLTGAUSIXNS-UHFFFAOYSA-N 202.213 2.760 5 40 BFBB Cc1cc(C(=O)c2ccc([N+](=O)[O-])cc2)ccn1 45038519 CXUYRFUEJGAJII-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB COCc1ccc([N+](=O)[O-])c2ccccc12 72227011 UJDHFGPDGVPYJF-UHFFFAOYSA-N 217.224 2.894 5 40 BFBB Cc1nn(C)c(S[C@H](C)C(C)C)c1[N+](=O)[O-] 78588947 KUULLOQCDDCTAJ-MRVPVSSYSA-N 243.332 2.773 5 40 BFBB Cc1cccc(/C=C\c2onc(C)c2[N+](=O)[O-])n1 108903438 XNHGVTDLRFSAPN-SREVYHEPSA-N 245.238 2.765 5 40 BFBB CSc1nc2cc([N+](=O)[O-])ccc2s1 34156508 WIPAKHOITFYBHA-UHFFFAOYSA-N 226.282 2.926 5 40 BFBB CC(=O)c1cccc(C(F)(F)F)c1[N+](=O)[O-] 169801710 MGVLJHZAFOXKOZ-UHFFFAOYSA-N 233.145 2.816 5 40 BFBB O=[N+]([O-])c1ccc(Oc2cccnc2)c(F)c1 58789637 COJOFPWHUBVJKK-UHFFFAOYSA-N 234.186 2.921 5 40 BFBB Cn1c2ccncc2c2cc([N+](=O)[O-])ccc21 66383 KKAZBBJRXDFIAA-UHFFFAOYSA-N 227.223 2.635 5 40 BFBB O=[N+]([O-])c1cncc(-c2ccccc2)c1 14983385 LXBLPKWPBMJMOW-UHFFFAOYSA-N 200.197 2.657 5 40 BFBB O=Cc1ncc(-c2ccc([N+](=O)[O-])cc2)s1 199792999 UHBYVTUCNBRTBI-UHFFFAOYSA-N 234.236 2.531 5 40 BFBB O=[N+]([O-])c1ccc(N2CCCC2)c2ccncc12 5688266 SHSLAKQAAOBHTA-UHFFFAOYSA-N 243.266 2.743 5 40 BFBB CCCC[C@H](CC)C[N+]1(C)CCOCC1 6379794 KKRGSSZASJPMRF-ZDUSSCGKSA-N 214.373 2.680 5 40 BFBB O=[N+]([O-])c1ccccc1-c1ccc(CO)cc1 71792102 GPXIDJYKHUWNSB-UHFFFAOYSA-N 229.235 2.754 5 40 BFBB O=C(O)c1cc2c([N+](=O)[O-])cccc2s1 82046875 VWBSZLRCSIQTCP-UHFFFAOYSA-N 223.209 2.508 5 40 BFBB in-vitro COc1cc2ncccc2c2cccnc12 1726679 MATJLKZMEUUKEN-UHFFFAOYSA-N 210.236 2.792 5 40 BFBB O=[N+]([O-])c1ccccc1CNCc1ccccc1 20038315 WEWJQVKHZUNSPG-UHFFFAOYSA-N 242.278 2.885 5 40 BFBB C[C@H](O)[C@H](C)SCc1cccc([N+](=O)[O-])c1 96430288 QLLUCUMCVWXISY-IUCAKERBSA-N 241.312 2.597 5 40 BFBB C[N+]1(Cc2ccco2)Cc2ccccc2C1 376827 CTPYPKIKNDTUMC-UHFFFAOYSA-N 214.288 2.940 5 40 BFBB C[C@H]1CC(C)(C)O[C@@H](C[N+]2(C)CCCCC2)O1 4184835 VUXRJJNWKQSEAV-STQMWFEESA-N 242.383 2.547 5 40 BFBB O=C1CCCC[C@@H]1c1ccc([N+](=O)[O-])cc1 39233585 FUKJIPWYXHNEPY-LLVKDONJSA-N 219.240 2.822 5 40 BFBB Cc1ccc2cc(F)c(C)c([N+](=O)[O-])c2n1 85399603 REAAIJCSGCRNOV-UHFFFAOYSA-N 220.203 2.899 5 40 BFBB Cc1cc([N+](=O)[O-])c(N2CCCC[C@H]2C)cc1N 226262347 IEUFONZVZGVPQY-SNVBAGLBSA-N 249.314 2.864 5 40 BFBB CN(C)c1ccc([N+](=O)[O-])c(C(C)(C)C)c1 642882618 UKHKZRITYLNUDN-UHFFFAOYSA-N 222.288 2.958 5 40 BFBB CCOc1ccc(/C=C/[N+](=O)[O-])cc1OCC 140329 QDNWHYOIWPSPEH-BQYQJAHWSA-N 237.255 2.731 5 40 BFBB biogenic O=[N+]([O-])c1ccc(-c2nc3ccccc3[nH]2)o1 493754 GOUDVMWLWAFVMC-UHFFFAOYSA-N 229.195 2.731 5 40 BFBB Cn1c2c(c3cc([N+](=O)[O-])ccc31)CCCC2 170663 VORLTYMMXXXFAP-UHFFFAOYSA-N 230.267 2.965 5 40 BFBB biogenic O=[N+]([O-])c1ccccc1-c1nccs1 34087125 PYJXAMIQMPCNSD-UHFFFAOYSA-N 206.226 2.718 5 40 BFBB in-vitro O=C1CCCC[C@@H]1[C@@H](C[N+](=O)[O-])c1ccccc1 4114273 STOOUUNOLPMRGC-OLZOCXBDSA-N 247.294 2.806 5 40 BFBB O=[N+]([O-])c1ccc(NCc2cccc(F)c2)nc1 20362213 XQMVLDVMPMDAGK-UHFFFAOYSA-N 247.229 2.741 5 40 BFBB O=[N+]([O-])c1c(NC2CC2)cccc1NC1CC1 57218622 ASTBJYMQFLPBJD-UHFFFAOYSA-N 233.271 2.743 5 40 BFBB in-vitro COc1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1 92589 RJNPADRCOGUIJU-UHFFFAOYSA-N 246.222 2.791 5 40 BFBB Cc1occc1C(=O)Oc1cccc([N+](=O)[O-])c1 6610492 IRTNXCGPCCUHGQ-UHFFFAOYSA-N 247.206 2.715 5 40 BFBB Cc1cc([N+](=O)[O-])cc(C)c1NC(=O)C(C)C 45888226 HKIHQGKPRBHZKH-UHFFFAOYSA-N 236.271 2.806 5 40 BFBB C[N+](C)(C)CC12CC3CC(CC(C3)C1)C2 96191848 RZRWCXZTEBCXHG-UHFFFAOYSA-N 208.369 2.909 5 40 BFBB Cc1c(C(C)C)[nH]c2c([N+](=O)[O-])cccc2c1=O 685937949 COPPIDZFYMARGJ-UHFFFAOYSA-N 246.266 2.868 5 40 BFBB CCC(C)(C)NC(=O)c1cccc([N+](=O)[O-])c1 2774397 NCPHALULGSYRBE-UHFFFAOYSA-N 236.271 2.513 5 40 BFBB Cc1c(CS[C@@H](C)CO)cccc1[N+](=O)[O-] 96430375 JVPHBFOTVAPMGE-QMMMGPOBSA-N 241.312 2.517 5 40 BFBB O=[N+]([O-])c1ccc2[nH]c3c(c2c1)CCC3 95931955 AMDGDBBFKCHJHW-UHFFFAOYSA-N 202.213 2.565 5 40 BFBB CC(C)Oc1ccc([N+](=O)[O-])c2cccnc12 225394173 ZBXZNIWRJJPOHB-UHFFFAOYSA-N 232.239 2.930 5 40 BFBB Cn1c(=O)c2ccccc2c2ccccc21 1726343 UWZASNFULUENAC-UHFFFAOYSA-N 209.248 2.692 5 40 BFBB C[N+]1(C[C@@H](O)c2ccccc2)CCCCCC1 4184496 XVHCXMDEIPVAEH-OAHLLOKOSA-N 234.363 2.741 5 40 BFBB O=[N+]([O-])c1cccc([C@H](O)c2ccccc2)c1 143568646 MFQIIAVCROYVQC-CYBMUJFWSA-N 229.235 2.677 5 40 BFBB O=C(c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 2392559 FJPVSNNBNWLDRK-UHFFFAOYSA-N 245.209 2.965 5 40 BFBB CCc1ccc(Oc2c([N+](=O)[O-])ncn2C)cc1 8317663 AGNUUVYBTXONPE-UHFFFAOYSA-N 247.254 2.683 5 40 BFBB CCCCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1 2534683 VWGLDQFLTIAJFQ-BQYQJAHWSA-N 248.282 2.524 5 40 BFBB O=[N+]([O-])c1cccc(N2CCCCC2)c1 34361577 RFXXAZWSYHLLOC-UHFFFAOYSA-N 206.245 2.585 5 40 BFBB O=[N+]([O-])[C@H]1CCCC[C@H]1c1ccccc1 17355034 JPUJWHOKGSAARG-RYUDHWBXSA-N 205.257 2.990 5 40 BFBB Cc1c(C(C)C)[nH]c2ccc([N+](=O)[O-])cc2c1=O 685938460 SZDPKNPXFNWWPK-UHFFFAOYSA-N 246.266 2.868 5 40 BFBB CCC[C@@]1([N+](C)(C)C)CS[C@H]1CC 1873893 DBTVVWUOYRIQLT-WDEREUQCSA-N 202.387 2.757 5 40 BFBB C[n+]1c2ccccc2nc2cc(Cl)ccc21 4783024 JLQCQEMBQOBEPJ-UHFFFAOYSA-N 229.690 2.866 5 40 BFBB CC(C)CCOC(=O)c1ccc([N+](=O)[O-])cc1 80702 KMOODDWVCAWHMC-UHFFFAOYSA-N 237.255 2.798 5 40 BFBB in-vitro O=[N+]([O-])c1cc(Cl)cc2[nH]nc(Cl)c12 14984754 XIWKZNOAASZIJT-UHFFFAOYSA-N 232.026 2.778 5 40 BFBB CC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 95761007 LJCYPWAXWYGFOO-UHFFFAOYSA-N 233.145 2.816 5 40 BFBB CCCCOc1c(C=O)cc(F)cc1[N+](=O)[O-] 225271198 FHBBNESXKCGPKP-UHFFFAOYSA-N 241.218 2.725 5 40 BFBB C=Cc1ccc(Cn2cc(C)c([N+](=O)[O-])n2)cc1 675032386 WKXIWETYQQJJCO-UHFFFAOYSA-N 243.266 2.791 5 40 BFBB O=c1oc2ccc(O)cc2c2ccccc12 398747 JIOCZMQHSOXWTI-UHFFFAOYSA-N 212.204 2.652 5 40 BFBB CC(=O)Nc1ccc2nc3ccccc3nc2c1 4812274 WWKXQHLLOBUTGE-UHFFFAOYSA-N 237.262 2.741 5 40 BFBB O=[N+]([O-])c1cccc(C2O[C@H]3CCCC[C@H]3O2)c1 30836423 FBLGHFGQOUTXPP-FUNVUKJBSA-N 249.266 2.951 5 40 BFBB O=[N+]([O-])c1ccccc1SC1=CCO1 95093067 HAKFNYOUYNUOHJ-UHFFFAOYSA-N 209.226 2.559 5 40 BFBB O=Cc1cc2ccccc2cc1[N+](=O)[O-] 38844799 SMFXJXWPJBCOHC-UHFFFAOYSA-N 201.181 2.561 5 40 BFBB O=NNc1ccc(-c2ccc([N+](=O)[O-])cc2)cn1 13213439 RLOUWMOPNWBORV-UHFFFAOYSA-N 244.210 2.750 5 40 BFBB C/C(=C\c1cn(C)c2ccccc12)[N+](=O)[O-] 4645041 GRJZAZKUTCLORK-VQHVLOKHSA-N 216.240 2.816 5 40 BFBB C[N+]1([C@H]2CC[C@@H]3CCC[C@H]2[C@H]3O)CCCCC1 5164612 IMXNJBZKYVFTKA-XGUBFFRZSA-N 238.395 2.557 5 40 BFBB CCNc1nc2ccc([N+](=O)[O-])cc2s1 45237618 QPKXEAITNWKLPR-UHFFFAOYSA-N 223.257 2.636 5 40 BFBB O=[N+]([O-])[C@@H]1CC=CC[C@@H]1C(Cl)(Cl)Cl 1727203 RGOMRHNULLJWNT-NTSWFWBYSA-N 244.505 2.968 5 40 BFBB Nc1ccc2c(=O)c3cccc(F)c3oc2c1 95115633 CQXVQRUYQXXVME-UHFFFAOYSA-N 229.210 2.668 5 40 BFBB O=[N+]([O-])c1cc2c(nc1Cl)CCCC2 4746966 ZKCCJTPLBDQLLO-UHFFFAOYSA-N 212.636 2.522 5 40 BFBB in-vitro CC(C)=CC(=O)Nc1cccc([N+](=O)[O-])c1C 22929137 NMMNBFBLRKRKMJ-UHFFFAOYSA-N 234.255 2.808 5 40 BFBB O=[N+]([O-])c1ccc2nc(-c3ccncc3)[nH]c2c1 13118288 MPOIUZUPKNLRIJ-UHFFFAOYSA-N 240.222 2.533 5 40 BFBB CC(=O)c1cccc([N+](=O)[O-])c1Br 38765247 CFTGOQFXFNMTIC-UHFFFAOYSA-N 244.044 2.560 5 40 BFBB CCOc1ccc([N+](=O)[O-])c(Br)c1 84193264 MQRFWCCICSGULX-UHFFFAOYSA-N 246.060 2.756 5 40 BFBB CCCC[N+](C)(C)CC[N+](C)(C)CCCC 1704446 NPMISLFPFLZDGM-UHFFFAOYSA-N 230.440 2.739 5 40 BFBB Cc1ccc2c([N+](=O)[O-])c(F)ccc2n1 3844205 PQRVSWVLDAPYBG-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB biogenic O=[N+]([O-])[C@@H]1CCCC[C@@H]1c1ccccc1 17355033 JPUJWHOKGSAARG-VXGBXAGGSA-N 205.257 2.990 5 40 BFBB CC(C)(C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 5900840 UNFBMIXQNNHAKT-UHFFFAOYSA-N 240.234 2.719 5 40 BFBB COc1cc(Br)c(C)c([N+](=O)[O-])c1 14983118 VMHCFQWEXWUPFT-UHFFFAOYSA-N 246.060 2.674 5 40 BFBB Cc1cc([N+](=O)[O-])c(N2CCCC[C@@H]2C)cc1N 226262335 IEUFONZVZGVPQY-JTQLQIEISA-N 249.314 2.864 5 40 BFBB O=[N+]([O-])c1cnccc1Sc1ccccn1 480486 PBXGRPCUPZQEDM-UHFFFAOYSA-N 233.252 2.536 5 40 BFBB CC[C@@H](C)NC(=O)Nc1cccc([N+](=O)[O-])c1 9256296 QUSGGPYCJPAOQF-MRVPVSSYSA-N 237.259 2.515 5 40 BFBB CCOC(=O)c1cc(Cl)cc([N+](=O)[O-])c1F 35333419 XVARMAKZJHINFU-UHFFFAOYSA-N 247.609 2.564 5 40 BFBB O=[N+]([O-])c1ccc(NC2[C@@H]3CCCC[C@@H]23)nc1 101455069 YCJHMNLRZOYPRP-NXEZZACHSA-N 233.271 2.590 5 40 BFBB Cc1cc(C)nc(Nc2cccc([N+](=O)[O-])c2)n1 1953153 HBABVFSYDLBIGJ-UHFFFAOYSA-N 244.254 2.745 5 40 BFBB CC(=O)Nc1cccc2ccc([N+](=O)[O-])cc12 5105968 SUMITEPKSIIMNM-UHFFFAOYSA-N 230.223 2.706 5 40 BFBB O=[N+]([O-])c1ccc2c(n1)[nH]c1ccccc12 5162809 MZRPARBJFRBBRX-UHFFFAOYSA-N 213.196 2.624 5 40 BFBB in-vitro CCNc1ccc(Cl)c([N+](=O)[O-])c1 35229022 PLPSKERNYGVTFK-UHFFFAOYSA-N 200.625 2.680 5 40 BFBB O=[N+]([O-])c1c(Cl)ncc(Cl)c1Cl 225736362 OWIVJWKLOMCHFL-UHFFFAOYSA-N 227.434 2.950 5 40 BFBB CCCc1nc2cc([N+](=O)[O-])cc(C)c2o1 226240836 OYOGFNOOAVZCDY-UHFFFAOYSA-N 220.228 2.997 5 40 BFBB Nc1cc(Oc2ccccc2)cc([N+](=O)[O-])c1 265810 WZFNPLLTTBTVQF-UHFFFAOYSA-N 230.223 2.969 5 40 BFBB O=[N+]([O-])c1ccnc2cc(Cl)ccc12 22054789 DNMLUVBXPFQOKB-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB in-vitro O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)C1CC1 36945998 XUWVQZIMPRHPLD-UHFFFAOYSA-N 230.223 2.669 5 40 BFBB in-vitro O=[N+]([O-])c1ccccc1-n1cnc2ccccc21 297682 BDWWFKRQAASYHR-UHFFFAOYSA-N 239.234 2.934 5 40 BFBB O=c1c2ccccc2ccc2ncccc12 971553 HOCIEUJADYTZNL-UHFFFAOYSA-N 207.232 2.748 5 40 BFBB C[C@@H](N)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 83592878 RZBQSBXQOWBINI-RXMQYKEDSA-N 234.177 2.633 5 40 BFBB CS[C@H](C)CNc1ccc([N+](=O)[O-])cc1 91504347 XJORMVYGRGIXNF-MRVPVSSYSA-N 226.301 2.758 5 40 BFBB C/C(=C/c1cc([N+](=O)[O-])ccc1Cl)[N+](=O)[O-] 2555890 QKJSTFFICPIBAA-XQRVVYSFSA-N 242.618 2.886 5 40 BFBB COc1ccc2c(=O)c3ccccc3oc2c1 4783187 HGWDKWJYTURSFE-UHFFFAOYSA-N 226.231 2.955 5 40 BFBB biogenic O=[N+]([O-])c1ccc(N[C@@H]2CC=CCC2)nc1 80120472 FXOLTOXNKHSSQG-SECBINFHSA-N 219.244 2.510 5 40 BFBB C[N+](C)(C)Cc1cccc(C(F)(F)F)c1 1664060 VNLLMRLHHMYVRE-UHFFFAOYSA-N 218.242 2.912 5 40 BFBB CCCCCSc1nc(C)[nH]c1[N+](=O)[O-] 5918622 HVZZPZWOHOXPGU-UHFFFAOYSA-N 229.305 2.909 5 40 BFBB Cc1nc([N+](=O)[O-])c2oc(-c3ccccc3)cn12 35326901 YMNYVFQBDVOBNU-UHFFFAOYSA-N 243.222 2.811 5 40 BFBB CC(C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 79062056 VAPWXCXRISCWEH-UHFFFAOYSA-N 246.270 2.509 5 40 BFBB Cc1c(F)cc([N+](=O)[O-])c2ncccc12 85399562 NTCOEHIAKAOXOF-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB CC[N+](CC)(CC)CCN(C)c1ccccc1 5333414 QXKYMMNNMNFTFM-UHFFFAOYSA-N 235.395 2.999 5 40 BFBB C[N@@+]1(Cc2cc(Cl)nc(Cl)c2)C=CN=C1 253589619 PCUAAXZOBZWYDI-HNNXBMFYSA-N 243.117 2.848 5 40 BFBB O=[N+]([O-])c1cccc(/C=C2\CCc3cn[nH]c32)c1 5072728 QWZYFIRSBDMABO-UXBLZVDNSA-N 241.250 2.805 5 40 BFBB O=[N+]([O-])c1cccc2sc(Cl)nc12 45238165 ROOKGSGAHAQZJW-UHFFFAOYSA-N 214.633 2.858 5 40 BFBB Cc1cc([N+](=O)[O-])ccc1C(=O)OC(C)(C)C 68813066 SDBMNQVAVVRJPG-UHFFFAOYSA-N 237.255 2.859 5 40 BFBB C[C@@H](Nc1ncccn1)c1cccc([N+](=O)[O-])c1 76846282 FWPUVTJKZYXGEV-SECBINFHSA-N 244.254 2.558 5 40 BFBB CN(C)c1ccc([N+](=O)[O-])c2ccccc12 39385516 JSSWGFLEONKUGN-UHFFFAOYSA-N 216.240 2.814 5 40 BFBB CC(C)n1cc2cc([N+](=O)[O-])ccc2n1 1556725 NIPPRKGSQUHQMO-UHFFFAOYSA-N 205.217 2.525 5 40 BFBB CCCC(=O)Nc1c(C)cc(C)cc1[N+](=O)[O-] 32109853 ABUMMPGHPDMGDU-UHFFFAOYSA-N 236.271 2.950 5 40 BFBB O=Cc1cccnc1Nc1cccc([N+](=O)[O-])c1 38860435 PCKXIXJNUSLUJR-UHFFFAOYSA-N 243.222 2.546 5 40 BFBB COc1ccccc1Oc1ccc([N+](=O)[O-])cn1 20272588 VFDPRAHSDKFOFS-UHFFFAOYSA-N 246.222 2.791 5 40 BFBB CCC(C)(C)c1ccc(O)c([N+](=O)[O-])c1 32166912 QMZBVXMQEWCXEL-UHFFFAOYSA-N 209.245 2.988 5 40 BFBB CN(C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 343123 ODCWNXRKYVORLL-UHFFFAOYSA-N 249.295 2.784 5 40 BFBB O=[N+]([O-])c1ccc(NCc2ccccc2F)nc1 20557040 GRWAAQLEEQKHDJ-UHFFFAOYSA-N 247.229 2.741 5 40 BFBB O=[N+]([O-])c1cc(Cl)c(Cl)c([N+](=O)[O-])c1 96328695 UDZACPYKQWPMBC-UHFFFAOYSA-N 236.998 2.810 5 40 BFBB COc1cccc2c(Cl)c([N+](=O)[O-])cnc12 165858274 KHBORCAUOJGAQM-UHFFFAOYSA-N 238.630 2.805 5 40 BFBB O=[N+]([O-])c1cc(OC(F)F)c(Cl)cc1F 34198318 INFPUXZKLSEHRC-UHFFFAOYSA-N 241.552 2.989 5 40 BFBB O=[N+]([O-])c1ccc(OC(F)F)c2ncccc12 604221688 VGOODWFJTIJRBF-UHFFFAOYSA-N 240.165 2.744 5 40 BFBB c1cnc2c3ccncc3c3nc[nH]c3c2c1 13211768 ZXIKBUYDGNYRBE-UHFFFAOYSA-N 220.235 2.659 5 40 BFBB O=[N+]([O-])c1cccc(OC2CCCC2)c1 96029244 CUMMJEGTDAVYMV-UHFFFAOYSA-N 207.229 2.916 5 40 BFBB CC(C)COC(=O)Nc1cccc([N+](=O)[O-])c1 320805 BNZGQTRZYDDPOY-UHFFFAOYSA-N 238.243 2.799 5 40 BFBB O=[N+]([O-])c1ccc(Oc2ccccc2CO)cc1 38080251 LHNICNCBMKHOTD-UHFFFAOYSA-N 245.234 2.879 5 40 BFBB O=[N+]([O-])c1ccnc(OCc2ccccc2)c1 82046702 FMPKDECCGQGBNX-UHFFFAOYSA-N 230.223 2.569 5 40 BFBB O=Cc1cccc2c([N+](=O)[O-])cccc12 1733818 JYJDWOKNSHADGZ-UHFFFAOYSA-N 201.181 2.561 5 40 BFBB biogenic O=[N+]([O-])c1ccc(-n2cc(Cl)cn2)c(F)c1 12396605 DLDDKSDPMODJIN-UHFFFAOYSA-N 241.609 2.573 5 40 BFBB Nc1cc2c(cc1[N+](=O)[O-])C1CCC2CC1 71404313 JGENUBNHQHCNCS-UHFFFAOYSA-N 218.256 2.932 5 40 BFBB O=C1c2cc([N+](=O)[O-])ccc2-c2cc(F)ccc21 1662446 HTHDIIFXKPOVRA-UHFFFAOYSA-N 243.193 2.945 5 40 BFBB CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 343089 HXAVFNKEMFPELQ-UHFFFAOYSA-N 235.268 2.760 5 40 BFBB Nc1cc(-c2ccccc2)cc([N+](=O)[O-])c1O 73642799 LGMCUAZDLPOSCV-UHFFFAOYSA-N 230.223 2.550 5 40 BFBB O=[N+]([O-])[C@H]1[C@H]2CC[C@H](C2)[C@H]1c1ccccc1 4684331 XLJNFVWRSYMVKN-XQHKEYJVSA-N 217.268 2.845 5 40 BFBB O=[N+]([O-])c1cccnc1N1CCc2ccccc21 6608746 QJCCWPRTLWKHAS-UHFFFAOYSA-N 241.250 2.684 5 40 BFBB CCC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 26896928 OGEKZGZVHGKFGG-UHFFFAOYSA-N 213.620 2.841 5 40 BFBB in-vitro O=[N+]([O-])c1cc(-n2cccc2)ccc1F 149142107 NBGNRDHMSULJBR-UHFFFAOYSA-N 206.176 2.525 5 40 BFBB COC(=O)c1sc2ccccc2c1[N+](=O)[O-] 338737 SUBAQJBSTGAVHA-UHFFFAOYSA-N 237.236 2.596 5 40 BFBB O=c1c2ccccc2[nH]c2c([N+](=O)[O-])cccc12 4430350 MMGYSMZGRLZCAS-UHFFFAOYSA-N 240.218 2.590 5 40 BFBB O=[N+]([O-])c1ccc2nc(-c3ccncc3)oc2c1 73640098 CHEHSQBXWBEYTH-UHFFFAOYSA-N 241.206 2.798 5 40 BFBB CC(=O)c1c(Br)cccc1[N+](=O)[O-] 82046842 QRRSPSMUACXMEC-UHFFFAOYSA-N 244.044 2.560 5 40 BFBB O=[N+]([O-])c1cccc2oc(C(F)(F)F)nc12 38518581 MVYGNYLHXPFQJV-UHFFFAOYSA-N 232.117 2.755 5 40 BFBB O=[N+]([O-])c1cc(Cn2cc(Cl)cn2)cs1 77956641 DUJMGVCVVQDWTE-UHFFFAOYSA-N 243.675 2.555 5 40 BFBB CCCCN(C)c1ccc([N+](=O)[O-])cc1 4115607 MITUDHRPTJOEPE-UHFFFAOYSA-N 208.261 2.831 5 40 BFBB C[C@H]1CNc2ccc([N+](=O)[O-])cc2S1 95644359 IRNFWVVQNLUOLF-LURJTMIESA-N 210.258 2.501 5 40 BFBB O=C(Nc1cccc([N+](=O)[O-])c1)c1ccsc1 22590181 NBRHRXBOIPXRCU-UHFFFAOYSA-N 248.263 2.909 5 40 BFBB CN(C)c1cccc([N+](=O)[O-])c1C(C)(C)C 68675217 XEJNRENDRVDYPI-UHFFFAOYSA-N 222.288 2.958 5 40 BFBB O=[N+]([O-])c1ccc(OCc2ccccn2)c(F)c1 72334119 JCIMNLNWSDBEOF-UHFFFAOYSA-N 248.213 2.708 5 40 BFBB Cc1cnn(-c2c(Cl)cccc2[N+](=O)[O-])c1 72334140 VIFCIRLIFPAWOE-UHFFFAOYSA-N 237.646 2.742 5 40 BFBB CSc1ccc(-c2cccc([N+](=O)[O-])c2)nn1 4355819 DXGFALXWLMQQMP-UHFFFAOYSA-N 247.279 2.774 5 40 BFBB CC[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 5665522 DXLLYIQIEGWYNQ-QMMMGPOBSA-N 222.244 2.579 5 40 BFBB O=[N+]([O-])c1ccc(-c2csc3[n+]2CCC3)cc1 4589957 OXGINGVLUBZZPB-UHFFFAOYSA-N 247.299 2.557 5 40 BFBB Cc1ccc(OCc2ccccc2[N+](=O)[O-])nc1 77240602 LXBCFDICENIMBF-UHFFFAOYSA-N 244.250 2.877 5 40 BFBB O=[N+]([O-])c1cc2c(Cl)ncnc2cc1Cl 38954247 VHFFODQAQLNACY-UHFFFAOYSA-N 244.037 2.845 5 40 BFBB c1cnc2c(c1)c1cccnc1c1nccnc21 34564455 NVFJXZGVAGNQDD-UHFFFAOYSA-N 232.246 2.726 5 40 BFBB O=c1c2ccccc2oc2ccc([N+](=O)[O-])cc12 5257562 NDCNIDLJNJJHRA-UHFFFAOYSA-N 241.202 2.854 5 40 BFBB O=[N+]([O-])c1ccc(Cl)c2cnccc12 71250535 IFAMHAYSMRYQCQ-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB Cc1cc([N+](=O)[O-])cn(CCC(C)(C)C)c1=O 187181407 UHYCEFLDRTWNEI-UHFFFAOYSA-N 238.287 2.501 5 40 BFBB O=[N+]([O-])c1ccc(-c2c[nH]c(=S)o2)cc1 199792969 KKUOBJWIWUEJJN-UHFFFAOYSA-N 222.225 2.912 5 40 BFBB CCOC(=O)c1coc2ccc([N+](=O)[O-])cc12 228957513 SBJHGVJUTQDHDV-UHFFFAOYSA-N 235.195 2.518 5 40 BFBB Cc1cc2ccc[n+](C)c2c2ncccc12 1707123 GRLLSRCNLRKLES-UHFFFAOYSA-N 209.272 2.521 5 40 BFBB O=[N+]([O-])c1ccc(NC2[C@H]3CCCC[C@H]23)nc1 101455062 YCJHMNLRZOYPRP-UWVGGRQHSA-N 233.271 2.590 5 40 BFBB O=[N+]([O-])c1ccc(-c2cccnc2)cc1 1437367 DKWZMBYPPLMXQO-UHFFFAOYSA-N 200.197 2.657 5 40 BFBB in-vitro CSc1ccc([N+](=O)[O-])cc1-c1ccn[nH]1 125387 OEXCWHTZQHSQPU-UHFFFAOYSA-N 235.268 2.707 5 40 BFBB O=[N+]([O-])c1c(-c2ccccc2)ccnc1F 257197534 CELHXCGASOPLJY-UHFFFAOYSA-N 218.187 2.796 5 40 BFBB O=Cc1cccc(Oc2ncccc2[N+](=O)[O-])c1 7185930 LAUZNQNMPICQFA-UHFFFAOYSA-N 244.206 2.595 5 40 BFBB CN(C(=O)c1cccc([N+](=O)[O-])c1)C1CCCC1 44901426 AGDFGWHNMKVFMW-UHFFFAOYSA-N 248.282 2.609 5 40 BFBB O=Cc1ncc(-c2ccccc2[N+](=O)[O-])s1 199791939 QCFGSZGRBFVFNV-UHFFFAOYSA-N 234.236 2.531 5 40 BFBB Cc1ccc(-c2ccc(CO)o2)c([N+](=O)[O-])c1 4290834 PQTZQCARCIDTFI-UHFFFAOYSA-N 233.223 2.656 5 40 BFBB CCCOC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 4726145 XVHWMVCZNBKASN-UHFFFAOYSA-N 243.646 2.815 5 40 BFBB O=[N+]([O-])c1cccc(-c2c[nH]c(=S)o2)c1 199792506 MQNGYSPXZPUTOH-UHFFFAOYSA-N 222.225 2.912 5 40 BFBB C[N+]1([C@H]2CC[C@@H]3CCC[C@H]2C3=O)CCCCC1 217498952 RDMYHQLYZMGUBF-MJBXVCDLSA-N 236.379 2.765 5 40 BFBB CCC(=O)Nc1c(C)cc([N+](=O)[O-])cc1C 45888184 DDVJMLXNKODOIH-UHFFFAOYSA-N 222.244 2.560 5 40 BFBB O=C(Oc1cccc([N+](=O)[O-])c1)c1ccccc1 3032984 JWLQSDXEKWFFBU-UHFFFAOYSA-N 243.218 2.814 5 40 BFBB biogenic C/C=C(\C)COC(=O)c1ccc([N+](=O)[O-])cc1 8649174 AIEQXEYCNMNHNS-YCRREMRBSA-N 235.239 2.718 5 40 BFBB O=[N+]([O-])c1ccc(O)c(Cl)c1Cl 32914721 SANZGCKGKOUHJG-UHFFFAOYSA-N 208.000 2.607 5 40 BFBB Cc1c(Cl)ccc2c(O)c([N+](=O)[O-])cnc12 256054021 UQMYPRTUSSQQGV-UHFFFAOYSA-N 238.630 2.810 5 40 BFBB Cc1cc(-c2ccc([N+](=O)[O-])cc2)cc(C)[n+]1[O-] 1556289 PCQZGHYSATYXOZ-UHFFFAOYSA-N 244.250 2.512 5 40 BFBB Cn1cnc([N+](=O)[O-])c1SCc1ccccc1 1679221 OYAJXQVODLOVLE-UHFFFAOYSA-N 249.295 2.621 5 40 BFBB O=c1[nH]c2cc(F)ccc2c2ccc(F)cc12 8637598 VNWWYNDTUKKDLX-UHFFFAOYSA-N 231.201 2.960 5 40 BFBB C/C=C\C=C\C(=O)Nc1ccc([N+](=O)[O-])cc1 17147368 FAWZPFLKIAIQCM-AWYLAFAOSA-N 232.239 2.666 5 40 BFBB CC(C)(C)c1nc2ccc([N+](=O)[O-])cc2[nH]1 32682419 GCTRLJKQRNSIOZ-UHFFFAOYSA-N 219.244 2.769 5 40 BFBB COc1cccc(Oc2ncccc2[N+](=O)[O-])c1 7185949 HDDMAKQPZVHIEH-UHFFFAOYSA-N 246.222 2.791 5 40 BFBB O=[N+]([O-])c1cnc(Oc2cccc(F)c2)s1 17117840 CVAUGARXUAHHLJ-UHFFFAOYSA-N 240.215 2.983 5 40 BFBB COc1c(O)ccc2c(=O)c3ccccc3oc12 13838742 WRPFBSLWEKZESU-UHFFFAOYSA-N 242.230 2.660 5 40 BFBB biogenic,in-vitro Cc1noc(-c2ccc(Cl)c([N+](=O)[O-])c2)n1 22120141 ULIOEHYPQHIYKV-UHFFFAOYSA-N 239.618 2.607 5 40 BFBB CC(C)CN1CCc2cc([N+](=O)[O-])ccc2C1 218744644 IEMNONPCVACGBV-UHFFFAOYSA-N 234.299 2.609 5 40 BFBB CC1(C)CN1Sc1ccc([N+](=O)[O-])cc1 1732541 KDOCCXVOBFQPJC-UHFFFAOYSA-N 224.285 2.696 5 40 BFBB CN(C)/C=C/c1ccc2cccnc2c1[N+](=O)[O-] 56981643 PQNZCVICGJMCPY-VQHVLOKHSA-N 243.266 2.675 5 40 BFBB CC1CCN(c2ccc([N+](=O)[O-])s2)CC1 4716689 BCAQSKUAJDPSDA-UHFFFAOYSA-N 226.301 2.893 5 40 BFBB C[C@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 39274103 ODZVIGSMSADIHT-JTQLQIEISA-N 220.272 2.831 5 40 BFBB CC[N+](C)(CC)CC[N+]1(C)CCCCCCC1 1594951 JLKRPLCAYMIPGG-UHFFFAOYSA-N 242.451 2.884 5 40 BFBB C/C=C/C=C/C(=O)Nc1ccc([N+](=O)[O-])cc1 4683020 FAWZPFLKIAIQCM-MQQKCMAXSA-N 232.239 2.666 5 40 BFBB O=[N+]([O-])c1cnc2onc(-c3ccccc3)c2c1 8429700 AEGYYIDFJHEWJK-UHFFFAOYSA-N 241.206 2.798 5 40 BFBB Nc1cccc(OCc2ccc([N+](=O)[O-])cc2)c1 1749017 OQEJITOWNQFKGL-UHFFFAOYSA-N 244.250 2.756 5 40 BFBB O=[N+]([O-])c1cccc(Oc2ccccn2)c1 20357531 CYAZJQRAXUNGCO-UHFFFAOYSA-N 216.196 2.782 5 40 BFBB CC(=O)c1ccc(NC(C)C)c([N+](=O)[O-])c1 9378978 KANORLCVEACARW-UHFFFAOYSA-N 222.244 2.618 5 40 BFBB COc1nc(-c2ccccc2)ccc1[N+](=O)[O-] 47211942 APSMCBRSSAYRKL-UHFFFAOYSA-N 230.223 2.665 5 40 BFBB O=[N+]([O-])c1ccc(-c2ccccc2)cn1 14983379 YPQXIVFXNVCVFI-UHFFFAOYSA-N 200.197 2.657 5 40 BFBB CCCCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 79670932 ZRLMFBOSLNCGQG-UHFFFAOYSA-N 224.216 2.846 5 40 BFBB CCn1cc([N+](=O)[O-])c(NC2CCCCC2)n1 95098546 MJLSYBKIXMUDAD-UHFFFAOYSA-N 238.291 2.556 5 40 BFBB CC/C(=C\c1ccc(OC)cc1OC)[N+](=O)[O-] 8581138 PQMRXWZJELZJOC-JXMROGBWSA-N 237.255 2.731 5 40 BFBB CC(C)(CCc1nc2ccccc2[nH]1)[N+](=O)[O-] 547473 PHHAUWYOHRAQGT-UHFFFAOYSA-N 233.271 2.551 5 40 BFBB Cc1cccc([N+](=O)[O-])c1C(F)(F)F 66323198 QSNTZLUZBNSESZ-UHFFFAOYSA-N 205.135 2.922 5 40 BFBB COc1ccc(-n2cccc2/C=C/[N+](=O)[O-])cc1 562976 JFLXOUGKKSBYLB-CSKARUKUSA-N 244.250 2.733 5 40 BFBB Cc1cc2cc(C)n(C)c2cc1[N+](=O)[O-] 35325042 DCYVEGIKRPUADR-UHFFFAOYSA-N 204.229 2.703 5 40 BFBB Cc1cccnc1C(=O)c1ccc([N+](=O)[O-])cc1 45028674 CIQKNJHBMVCRGW-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB Cc1ccc(C(=O)OC(C)(C)C)cc1[N+](=O)[O-] 68812899 JZHANKFEAOAAMF-UHFFFAOYSA-N 237.255 2.859 5 40 BFBB COc1cccc2c1oc(=O)c1ccccc12 1721292 PSTHDFUNPRGLLR-UHFFFAOYSA-N 226.231 2.955 5 40 BFBB O=[N+]([O-])c1ccc(Cc2ccc(O)cc2)cc1 1562026 LFZQCJLFQTXGKW-UHFFFAOYSA-N 229.235 2.891 5 40 BFBB O=[N+]([O-])c1cnc2ccc(F)cc2c1Cl 16697563 JTKXABQYVUAKJV-UHFFFAOYSA-N 226.594 2.936 5 40 BFBB C[N+](C)(C)Cc1ccc(C(F)(F)F)cc1 69452541 HUWSWVWLLGESMN-UHFFFAOYSA-N 218.242 2.912 5 40 BFBB CCC[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 5793870 YDEDJKADUVKMAE-SECBINFHSA-N 236.271 2.513 5 40 BFBB CC[C@H](CCC(=O)c1ccccc1)[N+](=O)[O-] 6002908 QHVUOXLSHJNRFB-LLVKDONJSA-N 221.256 2.705 5 40 BFBB O=[N+]([O-])c1cc(Br)c2cc[nH]c2c1 14984598 BVXHHQBPXSUJPE-UHFFFAOYSA-N 241.044 2.839 5 40 BFBB O=[N+]([O-])c1ccc(NCCc2ccccc2)nc1 20135396 OVXPVPWKPFWHFN-UHFFFAOYSA-N 243.266 2.644 5 40 BFBB Cc1ccc(N2CCCC2)c([N+](=O)[O-])c1 6070709 VQVVPXREFQQTBV-UHFFFAOYSA-N 206.245 2.503 5 40 BFBB O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CC12CCC2 342704 OMMCEGZFWNFGLK-LLVKDONJSA-N 246.266 2.724 5 40 BFBB CCCCCCC1OCC(CC)([N+](=O)[O-])CO1 4410860 ATYJGCJJUXGZTR-UHFFFAOYSA-N 245.319 2.755 5 40 BFBB O=[N+]([O-])c1ccc([C@@H]2C[C@]2(F)Cl)cc1 4671684 RBYIEBIWCJVVCR-DTWKUNHWSA-N 215.611 2.987 5 40 BFBB O=[N+]([O-])c1ccccc1CN1CCCCC1 1692028 QKNUYACRZCAJKF-UHFFFAOYSA-N 220.272 2.581 5 40 BFBB O=C(CC1CCC1)Nc1cccc([N+](=O)[O-])c1 550883 FRHSXEDUZLTDHX-UHFFFAOYSA-N 234.255 2.724 5 40 BFBB O=[N+]([O-])c1cc(C(F)(F)F)nn1C1CCCC1 72334103 FCXKQGBDPSPWII-UHFFFAOYSA-N 249.192 2.925 5 40 BFBB C[C@H](Cc1ccco1)Nc1ccc([N+](=O)[O-])cn1 25575662 JIMQUQJGZQQMDF-SECBINFHSA-N 247.254 2.626 5 40 BFBB O=C(O)C1(c2ccc([N+](=O)[O-])cc2)CCCCC1 36155110 RQTDZONBGWSSKR-UHFFFAOYSA-N 249.266 2.881 5 40 BFBB Cc1ccc(OCc2cc(C)no2)c([N+](=O)[O-])c1 32829882 KLHQUUXNKIPYCC-UHFFFAOYSA-N 248.238 2.779 5 40 BFBB Cc1ccc2[nH]c3c(c2c1)C[N+](C)(C)CC3 1322582 KVACXFYKYNXDJR-UHFFFAOYSA-N 215.320 2.609 5 40 BFBB biogenic O=Cc1ncc(-c2cccc([N+](=O)[O-])c2)s1 199792524 UWYMBKFIWFMKBJ-UHFFFAOYSA-N 234.236 2.531 5 40 BFBB O=C1c2cc([N+](=O)[O-])ccc2-c2c(F)cccc21 1693105 VNEYMHNYWQBPAG-UHFFFAOYSA-N 243.193 2.945 5 40 BFBB CCCC[N+]1(C)C[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C1 17301635 VQUSOYOKYIOOFB-UZSCSNNJSA-N 206.353 2.685 5 40 BFBB Nc1ccc(N)c2c(O)c3ccccc3c(O)c12 100514666 WGOXABJBDOYQFK-UHFFFAOYSA-N 240.262 2.569 5 40 BFBB O=C(O)c1cc2ccc([N+](=O)[O-])cc2s1 34581878 OQHZMCSQBFHZNU-UHFFFAOYSA-N 223.209 2.508 5 40 BFBB in-vitro O=[N+]([O-])c1ccccc1-c1nnc(Cl)s1 39151223 ZTXMVFGAERTTLS-UHFFFAOYSA-N 241.659 2.767 5 40 BFBB Cc1cc(C(=O)N2CCCCC2)ccc1[N+](=O)[O-] 5536552 MMUKTMAHTSXBCQ-UHFFFAOYSA-N 248.282 2.529 5 40 BFBB Nc1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1F 1395491 DRHUPORJDGFXNS-UHFFFAOYSA-N 249.201 2.503 5 40 BFBB CC[C@H](Sc1ccccc1[N+](=O)[O-])[N+](=O)[O-] 2042255 HIIWNXDQAASFMQ-VIFPVBQESA-N 242.256 2.700 5 40 BFBB CC(C)OC(=O)/C=C/c1cccc([N+](=O)[O-])c1 57465084 BWSKOBWSFMYAJP-VOTSOKGWSA-N 235.239 2.560 5 40 BFBB O=[N+]([O-])c1cccc(F)c1N1CCCCC1 67800461 VDMQJNKMOQZUJQ-UHFFFAOYSA-N 224.235 2.724 5 40 BFBB Cc1ccc(CNc2ncccc2[N+](=O)[O-])cc1 20404796 JJIAYQOBGONBFJ-UHFFFAOYSA-N 243.266 2.910 5 40 BFBB NCc1c2ccccc2nc2ccccc12 34395825 QBWKHBOHJPQSCI-UHFFFAOYSA-N 208.264 2.847 5 40 BFBB CC[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1C 372630 HTZCMMBSPIBFHX-QMMMGPOBSA-N 236.271 2.888 5 40 BFBB N[C@@H]1c2ccccc2-c2ccc([N+](=O)[O-])cc21 1599688 RZQUQYGHXCHOPI-CYBMUJFWSA-N 226.235 2.623 5 40 BFBB CC(C)COc1ccc(F)cc1[N+](=O)[O-] 67800623 OYFUJWGXUCLYHH-UHFFFAOYSA-N 213.208 2.769 5 40 BFBB CC1(C)CB(c2cccc([N+](=O)[O-])c2)OC1(C)C 584577916 SQQHIJGQWZBYTD-UHFFFAOYSA-N 247.103 2.628 5 40 BFBB O=[N+]([O-])c1ccc(NCc2ccc(F)cc2)nc1 20135392 XLGLIEYRSORUSV-UHFFFAOYSA-N 247.229 2.741 5 40 BFBB O=[N+]([O-])c1cccc(Oc2ccc(CO)cc2)c1 38080439 XZTZGVPWRHKWPW-UHFFFAOYSA-N 245.234 2.879 5 40 BFBB in-vitro O=[N+]([O-])c1ccc(-n2ccc(C(F)F)n2)cc1 685936785 YJYUPFDCPXIMTL-UHFFFAOYSA-N 239.181 2.718 5 40 BFBB O=Cc1csc(-c2ccc([N+](=O)[O-])cc2)n1 37974047 IIXIIEWUDZDHKJ-UHFFFAOYSA-N 234.236 2.531 5 40 BFBB Cc1cc([N+](=O)[O-])cc(C=O)c1OC(C)C 225272455 YVVOXRYTJVSKRM-UHFFFAOYSA-N 223.228 2.503 5 40 BFBB C[N+]1([C@H]2CC[C@H]3CCC[C@@H]2[C@@H]3O)CCCCC1 4318374 IMXNJBZKYVFTKA-CBBWQLFWSA-N 238.395 2.557 5 40 BFBB Cc1cccc([N+](=O)[O-])c1C(=O)N(C)C1CCC1 192619893 DKFDCNVEBGADBU-UHFFFAOYSA-N 248.282 2.528 5 40 BFBB Cc1cc(Br)cc(C)c1[N+](=O)[O-] 19801519 RBBIBDKTQQOFAG-UHFFFAOYSA-N 230.061 2.974 5 40 BFBB CC(C)c1n[nH]c(-c2ccc([N+](=O)[O-])cc2)n1 40175781 HZUGYNHKGAZAIA-UHFFFAOYSA-N 232.243 2.503 5 40 BFBB CC1(C)COC(c2ccccc2[N+](=O)[O-])OC1 3160050 PSKJVABQWREEDF-UHFFFAOYSA-N 237.255 2.666 5 40 BFBB O=[N+]([O-])c1ccc(F)cc1OC(F)(F)F 34303433 VBATUITURYFZIU-UHFFFAOYSA-N 225.097 2.633 5 40 BFBB O=[N+]([O-])c1cccc(-c2nccs2)c1 36379466 ITKRJFNDXYFPNU-UHFFFAOYSA-N 206.226 2.718 5 40 BFBB in-vitro CCCN(CC)Cc1cccc([N+](=O)[O-])c1 40119889 RDLDGQAPKZMMTA-UHFFFAOYSA-N 222.288 2.827 5 40 BFBB Cc1ccc(CNc2ccon2)cc1[N+](=O)[O-] 167777199 UBCGVRMVZLOKME-UHFFFAOYSA-N 233.227 2.503 5 40 BFBB O=[N+]([O-])c1cc(Cl)ccc1OCC(F)F 72209422 FWPOPXKZXJRYDE-UHFFFAOYSA-N 237.589 2.892 5 40 BFBB CC(=O)c1ccc2oc3ncccc3c(=O)c2c1 3643678 ZYGDCOJTJFQANG-UHFFFAOYSA-N 239.230 2.544 5 40 BFBB in-vitro CC[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 5593252 DXLLYIQIEGWYNQ-MRVPVSSYSA-N 222.244 2.579 5 40 BFBB O=[N+]([O-])c1cccc(-c2ccccn2)c1 11535638 OHEKHNZMCAMZNU-UHFFFAOYSA-N 200.197 2.657 5 40 BFBB O=[N+]([O-])c1cccnc1Nc1ccc(F)cc1 7185673 GCGLAEMIDHPYMS-UHFFFAOYSA-N 233.202 2.873 5 40 BFBB O=[N+]([O-])c1cccc(-c2nsc(Cl)n2)c1 47218935 SSDDIKIRKAFSBS-UHFFFAOYSA-N 241.659 2.767 5 40 BFBB O=[N+]([O-])c1ccccc1-c1ccc(Cl)nn1 36168376 MPEMOZHKVDQIOQ-UHFFFAOYSA-N 235.630 2.705 5 40 BFBB O=[N+]([O-])c1cccc(Cc2ccccc2)c1O 57352721 JVQHZDVKUVIABL-UHFFFAOYSA-N 229.235 2.891 5 40 BFBB COc1c([N+](=O)[O-])cc(F)cc1C(F)(F)F 169801730 YNMLHSILWHMYJW-UHFFFAOYSA-N 239.124 2.761 5 40 BFBB CC(C)(C)OC(=O)c1ccc([N+](=O)[O-])c(F)c1 38868980 CXQXHHIIMBWMCH-UHFFFAOYSA-N 241.218 2.689 5 40 BFBB Cc1cc(-c2csc(N)n2)ccc1[N+](=O)[O-] 263616165 HLVIIHYUNNMWGB-UHFFFAOYSA-N 235.268 2.609 5 40 BFBB O=[N+]([O-])c1ccc2nc(-c3ccco3)cn2c1 6740891 HDWQSOFXPKIOFE-UHFFFAOYSA-N 229.195 2.503 5 40 BFBB O=C1Sc2ccc([N+](=O)[O-])c3cccc1c23 5214521 CEBXTFFIYCIRMR-UHFFFAOYSA-N 231.232 2.994 5 40 BFBB CC(=O)Nc1c(Cl)cc(C)cc1[N+](=O)[O-] 216732905 QAEGMSUBMXBRSE-UHFFFAOYSA-N 228.635 2.515 5 40 BFBB Nc1cc2c(cc1[N+](=O)[O-])[nH]c1ccccc12 4823566 KKYPNNLXQHXFKM-UHFFFAOYSA-N 227.223 2.812 5 40 BFBB CC(C)(C)C(=O)Nc1cccc([N+](=O)[O-])c1 5726575 YYVSAQXZGZPPHQ-UHFFFAOYSA-N 222.244 2.579 5 40 BFBB CCCCCNCc1ccc([N+](=O)[O-])cc1 7261311 XPNKIPVBHUTBPP-UHFFFAOYSA-N 222.288 2.875 5 40 BFBB O=[N+]([O-])Cc1ncc(C(F)(F)F)cc1Cl 43224393 QFYJRXNYDDTTAW-UHFFFAOYSA-N 240.568 2.531 5 40 BFBB CCOC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 95829240 MMMHCLCYSGLACG-CMDGGOBGSA-N 235.239 2.561 5 40 BFBB COc1c(Br)cc(C)cc1[N+](=O)[O-] 146998904 CMLYAHYWAINDLT-UHFFFAOYSA-N 246.060 2.674 5 40 BFBB Nc1cccc2c(=O)c3cc(Cl)ccc3[nH]c12 6733659 JNUCQNMAERVVKA-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB CCc1cc([N+](=O)[O-])ccc1-n1cccc1 226315055 OVHYNUCOWIPJON-UHFFFAOYSA-N 216.240 2.948 5 40 BFBB CNc1cc(F)cc(Br)c1[N+](=O)[O-] 1504205432 BNPRPWDFMAGZOO-UHFFFAOYSA-N 249.039 2.538 5 40 BFBB Cc1c(NC(=O)C(C)(C)C)cccc1[N+](=O)[O-] 13988197 XRTWVKRGNWFODY-UHFFFAOYSA-N 236.271 2.888 5 40 BFBB O=Cc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 61798974 WKRPXDGGIYCVFN-UHFFFAOYSA-N 234.236 2.531 5 40 BFBB O=C(Nc1cccc([N+](=O)[O-])c1)NC1CCCC1 9389011 PRPKYQDXWFHKBW-UHFFFAOYSA-N 249.270 2.659 5 40 BFBB Cc1cc(OCc2ccccc2)ncc1[N+](=O)[O-] 77032201 XBBRWFKHXFNNTG-UHFFFAOYSA-N 244.250 2.877 5 40 BFBB Cc1cc([N+](=O)[O-])cc(C=O)c1OCC(C)C 225272681 QGVBTDGVUKKALU-UHFFFAOYSA-N 237.255 2.751 5 40 BFBB Cc1[nH]c2cc([N+](=O)[O-])ccc2c(=O)c1C(C)C 685938240 MRYGDOOXHBGYNB-UHFFFAOYSA-N 246.266 2.868 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1OC(F)(F)Cl 95215631 DAWCIFQBUJFWFX-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB CCC(C)(C)c1cc(N)c(O)c([N+](=O)[O-])c1 21983225 WLJLENRIPLYJSZ-UHFFFAOYSA-N 224.260 2.570 5 40 BFBB Cc1ccc2ncc([N+](=O)[O-])c(C)c2c1 256052959 PJFNRQSHTJWRHZ-UHFFFAOYSA-N 202.213 2.760 5 40 BFBB Cc1c(C(C)C)[nH]c2cc([N+](=O)[O-])ccc2c1=O 685938106 JUBZVWFKPQZVRO-UHFFFAOYSA-N 246.266 2.868 5 40 BFBB CC(=O)Nc1c(Cl)ccc([N+](=O)[O-])c1C 157935 WAMJCKGDUUHSKY-UHFFFAOYSA-N 228.635 2.515 5 40 BFBB CC(C)CNc1nc(Cl)ccc1[N+](=O)[O-] 36925896 CEURVZPCUQOWOW-UHFFFAOYSA-N 229.667 2.711 5 40 BFBB C[n+]1ccccc1/C=C/c1cccc([N+](=O)[O-])c1 1706251 WUYDGZXXFBLSTH-CMDGGOBGSA-N 241.270 2.590 5 40 BFBB Cc1cc(N2CCCC2)c([N+](=O)[O-])cc1C 45957768 HBFDBKXXBWKOOQ-UHFFFAOYSA-N 220.272 2.812 5 40 BFBB O=[N+]([O-])c1ccc2[nH]nc(OC3CCCC3)c2c1 72226533 RJDDYSRELVKRDJ-UHFFFAOYSA-N 247.254 2.793 5 40 BFBB O=[N+]([O-])c1ccc(OCC(F)F)c(Cl)c1 12395203 AGZKPDPIYLHYAE-UHFFFAOYSA-N 237.589 2.892 5 40 BFBB O=[N+]([O-])c1ccn(C/C=C/c2ccccc2)n1 71791999 VPHHZANQFITIGS-QPJJXVBHSA-N 229.239 2.505 5 40 BFBB COc1ccc2nc3ccccc3nc2c1 4782926 YGSXHEXJOFMTHZ-UHFFFAOYSA-N 210.236 2.792 5 40 BFBB biogenic COc1ccc2ccc3cccnc3c2n1 13220661 WUEXCLIYJQIBFO-UHFFFAOYSA-N 210.236 2.792 5 40 BFBB O=[N+]([O-])c1cc(OC(F)(F)Cl)ccc1F 95215498 TUAVSORZTGIROH-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB O=[N+]([O-])c1cc2cccnc2cc1Cl 1671643 PKJPESBDOWOQAI-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB in-vitro CNC(=O)Sc1ccc(C)c([N+](C)(C)C)c1 1595032 ZMCAYEZWSZFGGP-UHFFFAOYSA-O 239.364 2.623 5 40 BFBB Cc1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 12395194 HNSXRQOWSFWKMW-UHFFFAOYSA-N 235.161 2.844 5 40 BFBB CC[n+]1ccnc2cc3ccccc3cc21 28372 AXEWRJRLJWOMAI-UHFFFAOYSA-N 209.272 2.695 5 40 BFBB COC(=O)c1cc2c([N+](=O)[O-])cccc2s1 95093335 SUEKXWDIHCBEHT-UHFFFAOYSA-N 237.236 2.596 5 40 BFBB O=C1c2cc([N+](=O)[O-])ccc2-c2cccc(F)c21 1598767 NTGAQPLRGRIJPT-UHFFFAOYSA-N 243.193 2.945 5 40 BFBB Cc1ccc(-n2cccc2C=O)cc1[N+](=O)[O-] 1527078 MGTRUVNNPYVXPE-UHFFFAOYSA-N 230.223 2.506 5 40 BFBB O=[N+]([O-])c1cc(-c2ccncc2)ccc1F 47213539 WDOFFMHWMDPJSY-UHFFFAOYSA-N 218.187 2.796 5 40 BFBB CC[C@H](Cc1c[nH]c2ccccc12)[N+](=O)[O-] 532935 CDNXXVYBJAMWAK-SNVBAGLBSA-N 218.256 2.766 5 40 BFBB O=c1[nH]c2cccc([N+](=O)[O-])c2c2ccccc12 17429312 YNLNOOJGSMSZEY-UHFFFAOYSA-N 240.218 2.590 5 40 BFBB CC(C)CNc1ncnc2cccc([N+](=O)[O-])c12 96003745 JZKWMWKTFVTMMJ-UHFFFAOYSA-N 246.270 2.606 5 40 BFBB N[C@H]1c2ccccc2-c2ccc([N+](=O)[O-])cc21 5742718 RZQUQYGHXCHOPI-ZDUSSCGKSA-N 226.235 2.623 5 40 BFBB O=C(c1ccc(O)cc1)c1ccc([N+](=O)[O-])cc1 38237571 ZEYDQRVULMQZIU-UHFFFAOYSA-N 243.218 2.531 5 40 BFBB COc1ccc2c(C)cc(C)nc2c1[N+](=O)[O-] 85385473 DGRVAVJJQUPIPN-UHFFFAOYSA-N 232.239 2.768 5 40 BFBB CN(C)c1ccn2c(=O)c3ccccc3cc2c1 3847849 JZQWRUQZWTZAIX-UHFFFAOYSA-N 238.290 2.519 5 40 BFBB biogenic c1cnc2nc3[nH]c4ccccc4c3nc2c1 8616463 KRJWJQRAQSHZCW-UHFFFAOYSA-N 220.235 2.659 5 40 BFBB O=[N+]([O-])c1cc(-c2c[nH]cn2)ccc1Cl 148561717 MJWMDNAEFLUTSE-UHFFFAOYSA-N 223.619 2.638 5 40 BFBB CC/C(=C/c1ccc(OC)c(OC)c1)[N+](=O)[O-] 1651822 NRBCNHBQBWHAJU-YFHOEESVSA-N 237.255 2.731 5 40 BFBB O=[N+]([O-])[C@H]1CC=CC[C@@H]1C(Cl)(Cl)Cl 1727205 RGOMRHNULLJWNT-WDSKDSINSA-N 244.505 2.968 5 40 BFBB O=C(O)CCCc1ccc([N+](=O)[O-])cc1Cl 1749466 NWYKLYOAOAKROW-UHFFFAOYSA-N 243.646 2.656 5 40 BFBB CC(=O)Nc1cccc(C(F)(F)F)c1[N+](=O)[O-] 4416638 ITMONGJWFZBCRS-UHFFFAOYSA-N 248.160 2.572 5 40 BFBB COc1cccc2nc3ccc(F)cc3nc12 76495126 BOOWHJMKWQCCQO-UHFFFAOYSA-N 228.226 2.931 5 40 BFBB CC[C@@H](C)Nc1ccc(C(=O)O)cc1[N+](=O)[O-] 13276762 DQBNOZHZXARJLB-SSDOTTSWSA-N 238.243 2.503 5 40 BFBB O=[N+]([O-])c1ccccc1-n1ccc(C(F)F)n1 685936572 HJMYTPMDSLUZCH-UHFFFAOYSA-N 239.181 2.718 5 40 BFBB CSc1ccc(Cn2cnc([N+](=O)[O-])c2)cc1 26980574 MZVDLPJRVRIHAK-UHFFFAOYSA-N 249.295 2.562 5 40 BFBB Cc1cc(-c2cc(N)cc([N+](=O)[O-])c2)ccn1 98175333 OJAOTOPTSCHPGK-UHFFFAOYSA-N 229.239 2.547 5 40 BFBB C[N+]1(CCC(=O)c2ccccc2)CCCCC1 1572953 XIVHZDKCWDUTJT-UHFFFAOYSA-N 232.347 2.890 5 40 BFBB CC(C)([C@@H](O)c1ccc2ccccc2c1)[N+](=O)[O-] 39257872 SPOVJZNIJBQEQC-ZDUSSCGKSA-N 245.278 2.929 5 40 BFBB Cc1nc(Sc2ccncc2)ccc1[N+](=O)[O-] 97022632 OKTJWKFDFDRESR-UHFFFAOYSA-N 247.279 2.844 5 40 BFBB O=[N+]([O-])c1ccc(-c2noc(C3CC3)n2)cc1 13921033 LPEGHOWUROGQHX-UHFFFAOYSA-N 231.211 2.522 5 40 BFBB O=[N+]([O-])c1c(C(F)F)n[nH]c1-c1ccccc1 16159160 KUGNZJQBVWLMFO-UHFFFAOYSA-N 239.181 2.923 5 40 BFBB CC[C@H](C)Nc1ccc([N+](=O)[O-])cc1C(=O)O 19844599 SJBHQRYWCGLSEQ-ZETCQYMHSA-N 238.243 2.503 5 40 BFBB O=[N+]([O-])c1ccc(-c2nc3cnccc3[nH]2)cc1 1571819 GQHMDQHMZUMRMK-UHFFFAOYSA-N 240.222 2.533 5 40 BFBB Nc1ccc2c(c1)[nH]c(=O)c1cc(Cl)ccc12 8627715 XBZUMGORNJVOQD-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB C[C@]1(F)Cc2cc3c(c([N+](=O)[O-])c2C1=O)CCC3 2049305484 JRNKCMLBLMQWCY-ZDUSSCGKSA-N 249.241 2.551 5 40 BFBB Cc1ccccc1Sc1c([N+](=O)[O-])ncn1C 5634979 SAIRAFVUWDTSLH-UHFFFAOYSA-N 249.295 2.788 5 40 BFBB Cc1cnc(Sc2ccncc2)c([N+](=O)[O-])c1 95977464 SNEDALLRARGGHL-UHFFFAOYSA-N 247.279 2.844 5 40 BFBB CC[C@H](C)NC(=O)Nc1cccc([N+](=O)[O-])c1 9256298 QUSGGPYCJPAOQF-QMMMGPOBSA-N 237.259 2.515 5 40 BFBB Cc1nc(-c2ccc(Cl)c([N+](=O)[O-])c2)no1 3882689 OQMRBJFNWODKHP-UHFFFAOYSA-N 239.618 2.607 5 40 BFBB O=[N+]([O-])c1cc2ncccc2cc1Cl 82049610 LXRBVAIZFZZRLS-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB O=c1c2ccccc2[nH]c2ccc([N+](=O)[O-])cc12 4430352 MJYGRUSMTCUJGK-UHFFFAOYSA-N 240.218 2.590 5 40 BFBB Cc1ccc(Oc2c([N+](=O)[O-])ncn2C)c(C)c1 8319194 UBTVCPYGYSQTRY-UHFFFAOYSA-N 247.254 2.737 5 40 BFBB CC(C)(C)C(=O)COc1cccc([N+](=O)[O-])c1 37974501 ZXEDXLRECZMNOU-UHFFFAOYSA-N 237.255 2.589 5 40 BFBB CCOC(=O)c1cc2c(C)ccc([N+](=O)[O-])c2[nH]1 39204493 JYZODQLAYLYUAS-UHFFFAOYSA-N 248.238 2.561 5 40 BFBB C[N+]1(C[C@H](O)c2ccccc2)CCCCCC1 4184495 XVHCXMDEIPVAEH-HNNXBMFYSA-N 234.363 2.741 5 40 BFBB COc1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 169800317 KZGFIPMWOVVLAZ-UHFFFAOYSA-N 237.133 2.502 5 40 BFBB C/C=C/C=C/C(=O)Nc1cccc([N+](=O)[O-])c1 6406004 RZCQKVMUVCLONJ-CRBCFSCISA-N 232.239 2.666 5 40 BFBB CCc1[nH]c2cc([N+](=O)[O-])ccc2c(=O)c1CC 685938501 WACBATVLZHANFD-UHFFFAOYSA-N 246.266 2.561 5 40 BFBB O=[N+]([O-])c1ccnc(NC2CCCCC2)c1 31671537 PQHBQQXFELRBHX-UHFFFAOYSA-N 221.260 2.734 5 40 BFBB O=[N+]([O-])c1cccc2c3c([nH]c12)CCCC3 235721 VHIZJSVECYVZTO-UHFFFAOYSA-N 216.240 2.955 5 40 BFBB O=C(O)c1ccc([N+](=O)[O-])cc1-c1ccccc1 39151303 ZEBINUQQXMHHJE-UHFFFAOYSA-N 243.218 2.960 5 40 BFBB in-vitro COCC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1F 45038752 VZPZXCCHGSFRIP-MRVPVSSYSA-N 242.250 2.571 5 40 BFBB COc1cc2c(cc1/C=C(\C)[N+](=O)[O-])O[C@H](C)C2 4160038 DBZWDPBKQWJZKV-VGANXODHSA-N 249.266 2.656 5 40 BFBB C[N+](C)(C)[C@]12CCCCC[C@H]1SC2 5574533 BJUOZXBHRNHPCL-MNOVXSKESA-N 200.371 2.511 5 40 BFBB CC(C)c1cc([N+](=O)[O-])c2nc(N)sc2c1 5042463 QAQFRULOVHXNNP-UHFFFAOYSA-N 237.284 2.910 5 40 BFBB CCOC(=O)Nc1c(C)cc(C)cc1[N+](=O)[O-] 5257011 GCKDOICAJSXPMO-UHFFFAOYSA-N 238.243 2.780 5 40 BFBB CC(C)N[C@H](C)Cc1ccc([N+](=O)[O-])cc1 5462915 GVVMWRCBLWSEPK-SNVBAGLBSA-N 222.288 2.524 5 40 BFBB O=[N+]([O-])c1cccc(OC(F)(F)Cl)c1F 95215427 MYBLDIMDEITODD-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB COc1ccc(Cl)cc1/C=C/[N+](=O)[O-] 476360 BYGULCFTNGPRRD-SNAWJCMRSA-N 213.620 2.596 5 40 BFBB C/C(=C/c1c[nH]c2ccccc12)[N+](=O)[O-] 40307 BPAQTDYDNBMYAM-VURMDHGXSA-N 202.213 2.805 5 40 BFBB CCOc1cc(C)nc2ccc([N+](=O)[O-])cc12 95532227 ZHBAPAAILBKWKM-UHFFFAOYSA-N 232.239 2.850 5 40 BFBB Cc1cc(C)c2c(N)c3ccccc3nc2n1 274981 TZNYLDDNIITWPM-UHFFFAOYSA-N 223.279 2.982 5 40 BFBB aggregator O=C(O)c1c(Cl)cc([N+](=O)[O-])cc1Cl 75629386 UCVGAAAMGILBOD-UHFFFAOYSA-N 236.010 2.600 5 40 BFBB Cc1cccc2cc3ccccc3c(=O)n12 3847880 PRXLOHPMRFHFRG-UHFFFAOYSA-N 209.248 2.761 5 40 BFBB biogenic Cc1ccc([N+](=O)[O-])c(OCC(F)(F)F)c1 12396695 BVILCJNIDGHVFS-UHFFFAOYSA-N 235.161 2.844 5 40 BFBB O=[N+]([O-])c1ccc2ccccc2c1[N+](=O)[O-] 4257819 XNKFCDGEFCOQOM-UHFFFAOYSA-N 218.168 2.656 5 40 BFBB COc1ccc(-c2cc([N+](=O)[O-])ccc2O)cc1 12504742 LBOZGNDBSCRERA-UHFFFAOYSA-N 245.234 2.976 5 40 BFBB Cc1c(F)cc2cccnc2c1[N+](=O)[O-] 85399601 UIJUNDGCSKQXHF-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB Cc1cc([N+](=O)[O-])c(N)cc1N1CCC[C@H](C)C1 216863500 HFZPANOCCLCWQS-VIFPVBQESA-N 249.314 2.722 5 40 BFBB COc1cc2c(cc1[N+](=O)[O-])C(=O)CCCC2 5369151 OQEMREQQWHVDSF-UHFFFAOYSA-N 235.239 2.513 5 40 BFBB CC(C)c1n[nH]c(-c2ccccc2[N+](=O)[O-])n1 46085290 KNCCKNBODVJWGC-UHFFFAOYSA-N 232.243 2.503 5 40 BFBB O=[N+]([O-])c1cc(Br)ccc1S 42389830 AJQYWSYQGXVQBM-UHFFFAOYSA-N 234.074 2.646 5 40 BFBB CN(C)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] 45958914 BURDOVGYXAUXQM-UHFFFAOYSA-N 235.070 2.968 5 40 BFBB O=[N+]([O-])[C@H]1CC=CC[C@H]1C(Cl)(Cl)Cl 1727206 RGOMRHNULLJWNT-RITPCOANSA-N 244.505 2.968 5 40 BFBB O=[N+]([O-])[C@@H]1CC=CC[C@H]1C(Cl)(Cl)Cl 1727204 RGOMRHNULLJWNT-PHDIDXHHSA-N 244.505 2.968 5 40 BFBB O=C(c1ccccc1)c1ccc(O)c([N+](=O)[O-])c1 35938706 UUPWIFSQHLDLNE-UHFFFAOYSA-N 243.218 2.531 5 40 BFBB Cc1ccc([C@@](C)(O)C(F)(F)F)cc1[N+](=O)[O-] 43368070 SEHNLXPTGZIGIP-SECBINFHSA-N 249.188 2.673 5 40 BFBB Cc1cc2c(cc1[N+](=O)[O-])-c1ncccc1C2 63342 GWKUEFXRRCFGNT-UHFFFAOYSA-N 226.235 2.869 5 40 BFBB O=[N+]([O-])c1cc(-c2ccc(O)cc2)ccc1O 24718402 RTMAIRQMOJFXRN-UHFFFAOYSA-N 231.207 2.673 5 40 BFBB COc1cc(Cl)c(C)cc1[N+](=O)[O-] 66055325 CKIFFDUKUXANNM-UHFFFAOYSA-N 201.609 2.565 5 40 BFBB COC(=O)c1cccc2cccc([N+](=O)[O-])c12 57353813 VURKLKJITIJNAC-UHFFFAOYSA-N 231.207 2.535 5 40 BFBB O=[N+]([O-])c1ccccc1N1CCC=C(F)C1 95997063 JHJVJFOJCOYKMX-UHFFFAOYSA-N 222.219 2.658 5 40 BFBB O=C(O)c1cc2cccc([N+](=O)[O-])c2s1 39410735 DFUCCKMJARLWKG-UHFFFAOYSA-N 223.209 2.508 5 40 BFBB CC(C)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C 71799869 OPYXGYQNZLBNRZ-VIFPVBQESA-N 248.282 2.528 5 40 BFBB Cc1cc2c(nc1[N+](=O)[O-])[nH]c1ccccc12 77311701 YETURKHPVJNYTO-UHFFFAOYSA-N 227.223 2.933 5 40 BFBB in-vitro Cc1noc(/C=C\c2ccco2)c1[N+](=O)[O-] 33365049 BTBANLFSKWQHNF-PLNGDYQASA-N 220.184 2.655 5 40 BFBB O=[N+]([O-])c1ccc(OC(F)(F)Cl)cc1F 95215517 LWZBOWLZEUNEKU-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB CC1=NN=C(C)C1=Cc1ccccc1[N+](=O)[O-] 5430695 KUIGAWURIBZCFH-UHFFFAOYSA-N 229.239 2.829 5 40 BFBB O=c1[nH]c2ccccc2c2ccc([N+](=O)[O-])cc12 17380302 DWJTXUCDDWXLSX-UHFFFAOYSA-N 240.218 2.590 5 40 BFBB O=[N+]([O-])c1ccc(NCc2ccc(O)cc2)cc1 35018435 GGNYHWLRWFSDMB-UHFFFAOYSA-N 244.250 2.913 5 40 BFBB CC[N+](C)(CC)C[Si](C)(C)c1ccccc1 195793363 CTWTXSBJQQFUAU-UHFFFAOYSA-N 236.455 2.628 5 40 BFBB Nc1c([N+](=O)[O-])cc(Cl)c(Cl)c1F 5217382 XAERYMGJAJIADA-UHFFFAOYSA-N 225.006 2.623 5 40 BFBB C[n+]1c2ccccc2c(C(=O)O)c2ccccc21 22054048 FEPLFOBGEPKMRG-UHFFFAOYSA-O 238.266 2.516 5 40 BFBB in-vitro Cc1ccc([N+](=O)[O-])cc1-c1ccc(C(=O)O)o1 359367 ZHMGMTLVNRVTPW-UHFFFAOYSA-N 247.206 2.861 5 40 BFBB Cc1ccc(/C=C\c2onc(C)c2[N+](=O)[O-])o1 13483789 DDIAPZSIMIVACO-WAYWQWQTSA-N 234.211 2.963 5 40 BFBB Nc1cc(Cl)cc2c1[nH]c(=O)c1ccccc12 16921908 RPHDVDPPAGWMNV-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB COc1cc(C)nc2ccc(C)c([N+](=O)[O-])c12 64219844 NMAMIOKUYQJNBJ-UHFFFAOYSA-N 232.239 2.768 5 40 BFBB COC(=O)c1cc2cccc([N+](=O)[O-])c2s1 91696101 RJUVQMBNXODKGH-UHFFFAOYSA-N 237.236 2.596 5 40 BFBB CCc1ccc(-c2n[nH]cc2[N+](=O)[O-])cc1 42415206 UGOPXMMROFQWFZ-UHFFFAOYSA-N 217.228 2.547 5 40 BFBB O=[N+]([O-])c1ccnc(C(F)(F)C(F)(F)F)c1 169803976 ZLRXUWQXQXSDIA-UHFFFAOYSA-N 242.103 2.644 5 40 BFBB CCc1c(C)[nH]c2c([N+](=O)[O-])cccc12 1598639 IGTRZDVDURLEHH-UHFFFAOYSA-N 204.229 2.947 5 40 BFBB COc1ccccc1Nc1ccncc1[N+](=O)[O-] 4894858 DMXWSIDTHHQPCK-UHFFFAOYSA-N 245.238 2.742 5 40 BFBB O=[N+]([O-])c1cc(Cl)cc2nc(S)oc12 71981117 MNXNEWOKLZIMFI-UHFFFAOYSA-N 230.632 2.678 5 40 BFBB O=[N+]([O-])c1ccc(NCCc2ccccn2)s1 54389465 DVNIZGZSLHOLIR-UHFFFAOYSA-N 249.295 2.706 5 40 BFBB CC(=O)Nc1c(C)c(C)c([N+](=O)[O-])c(C)c1C 4127990 URGRREOQYMUENM-UHFFFAOYSA-N 236.271 2.787 5 40 BFBB Cc1cc(Br)sc1[N+](=O)[O-] 480664 NSDDIMXESDSJEE-UHFFFAOYSA-N 222.063 2.727 5 40 BFBB CC(=C/C(=O)O)/C=C/c1ccc([N+](=O)[O-])cc1 1759119 JGOBGAMTXYHXIO-BVCYWKNDSA-N 233.223 2.639 5 40 BFBB C/C(=C/c1ccc(/C=C(/C)[N+](=O)[O-])cc1)[N+](=O)[O-] 2145338 YDRFYIMGSXCFJK-XOHWUJONSA-N 248.238 2.962 5 40 BFBB O=[N+]([O-])c1ccc(Cl)c(OC(F)F)c1 84199250 KNCUHUWZNNXBGA-UHFFFAOYSA-N 223.562 2.850 5 40 BFBB in-vitro COc1ccc(-c2oncc2C)cc1[N+](=O)[O-] 85395288 SNDHZFREABPUDH-UHFFFAOYSA-N 234.211 2.567 5 40 BFBB O=[N+]([O-])c1cnc(-c2ccccc2)nc1Cl 115371315 TZJXYWAYBPFLOW-UHFFFAOYSA-N 235.630 2.705 5 40 BFBB CCC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 4427580 WDSXPRGHVIEVDF-UHFFFAOYSA-N 218.212 2.669 5 40 BFBB in-vitro Cn1ccnc1SCc1ccccc1[N+](=O)[O-] 8785895 JQMTWRNGPMWTHO-UHFFFAOYSA-N 249.295 2.621 5 40 BFBB C[C@H]1CCCCN1c1ccc(N)cc1[N+](=O)[O-] 226262294 KLEUMZQUVBLPIC-VIFPVBQESA-N 235.287 2.556 5 40 BFBB Cc1cc(OCC(F)F)ccc1[N+](=O)[O-] 12395198 RCEZMBSUAGBHQN-UHFFFAOYSA-N 217.171 2.547 5 40 BFBB Cc1ccc2nc3c(O)cccc3nc2c1 76495116 CHFLVPPHJPKYEK-UHFFFAOYSA-N 210.236 2.797 5 40 BFBB CN(C)c1cc2nc3ccccc3nc2cc1O 104193085 ZOBFSXUEDFQVAI-UHFFFAOYSA-N 239.278 2.555 5 40 BFBB CCOC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 3237219 UJURCUUMMNSSKF-UHFFFAOYSA-N 244.634 2.817 5 40 BFBB C[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 20064301 VSRXWIQZKKUECL-HZGVNTEJSA-N 222.200 2.626 5 40 BFBB O=c1cc(O)c2ccc3ccccc3c2o1 6576436 DYVMMOSLXBYVAQ-UHFFFAOYSA-N 212.204 2.652 5 40 BFBB O=[N+]([O-])c1cccc(CSc2ncc[nH]2)c1 78993284 VJTWPXVCOPVXKD-UHFFFAOYSA-N 235.268 2.610 5 40 BFBB O=C(c1cccc([N+](=O)[O-])c1)N1CCCCCC1 123368 QZPFXAPNWAMVJA-UHFFFAOYSA-N 248.282 2.611 5 40 BFBB c1ccc2nc3c(nnc4ccccc43)nc2c1 1401017 QJVIPBFFRIJDBV-UHFFFAOYSA-N 232.246 2.726 5 40 BFBB Cc1ccc2oc3cc(O)ccc3c(=O)c2c1 5619003 JIXRMWNSKAVBJB-UHFFFAOYSA-N 226.231 2.960 5 40 BFBB C[N+](C)(C)C[C@H]1CCCc2ccccc2C1=O 5940140 PRDRPTLZIYOOFW-CYBMUJFWSA-N 232.347 2.528 5 40 BFBB NCCCNc1ccc([N+](=O)[O-])c2ccccc12 5800547 IONZQRWHUSCAAZ-UHFFFAOYSA-N 245.282 2.509 5 40 BFBB CC(C)(C)Nc1ccc(C(=O)O)cc1[N+](=O)[O-] 13276928 ROOAGYYJHLOOBN-UHFFFAOYSA-N 238.243 2.503 5 40 BFBB Nc1ccccc1Sc1cccnc1[N+](=O)[O-] 40447817 RUAGIEQBMLTNGX-UHFFFAOYSA-N 247.279 2.723 5 40 BFBB C[C@H]1CCC[C@@H]1OC(=O)c1ccc([N+](=O)[O-])cc1 1700423 JEPOOXKTKKVJQR-CABZTGNLSA-N 249.266 2.940 5 40 BFBB C[C@H](N)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 83592875 RZBQSBXQOWBINI-YFKPBYRVSA-N 234.177 2.633 5 40 BFBB COc1ccc([N+](=O)[O-])c2c([N+](=O)[O-])cccc12 36719679 HERPVWGXVFBZOV-UHFFFAOYSA-N 248.194 2.665 5 40 BFBB OC/C=C/c1cccc2nc3ccccc3nc12 85390998 QYVRYKFTYIOYMJ-GQCTYLIASA-N 236.274 2.789 5 40 BFBB Cc1cc([N+](=O)[O-])c(N)cc1N1CCCC[C@H]1C 216863275 KFYAQQWBLHTHHQ-SNVBAGLBSA-N 249.314 2.864 5 40 BFBB Cc1c([N+](=O)[O-])cnc2c(C)cccc12 256049834 BRBBSTHDMVIYDD-UHFFFAOYSA-N 202.213 2.760 5 40 BFBB Cc1cnc(Sc2ccccn2)c([N+](=O)[O-])c1 481418 VMWJAAJRDRMLQU-UHFFFAOYSA-N 247.279 2.844 5 40 BFBB CCC[C@@H](C)OC(=O)c1cccc([N+](=O)[O-])c1 1669862 LPXMRDZFWZZBEY-SECBINFHSA-N 237.255 2.940 5 40 BFBB biogenic NCc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 69330743 CRFUQOBFGBMGSM-UHFFFAOYSA-N 244.250 2.846 5 40 BFBB C[C@H]1Cc2cc3c(c([N+](=O)[O-])c2C1)CCC3 2113474299 MAODTMDZZYRTLL-QMMMGPOBSA-N 217.268 2.818 5 40 BFBB O=[N+]([O-])c1ccc(Nc2ccccc2F)nc1 4739847 JTPLWEDCOMLFRD-UHFFFAOYSA-N 233.202 2.873 5 40 BFBB Cc1ccc2c([N+](=O)[O-])ccc(S)c2n1 26460682 PDGQCYBGUWDDML-UHFFFAOYSA-N 220.253 2.740 5 40 BFBB C[N+]1([C@H]2CC[C@@H]3CCC[C@@H]2C3=O)CCCCC1 100291513 RDMYHQLYZMGUBF-IHRRRGAJSA-N 236.379 2.765 5 40 BFBB C[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 4367260 YRGAWWJSVRCDAL-JTQLQIEISA-N 220.272 2.831 5 40 BFBB O=[N+]([O-])c1cccc2c(O)c(Cl)cnc12 19721859 XDDZQXQZUBKOKM-UHFFFAOYSA-N 224.603 2.502 5 40 BFBB O=C(C[C@@H]1C=CCC1)Nc1cccc([N+](=O)[O-])c1 23324814 HALMMSDAAYVROD-SNVBAGLBSA-N 246.266 2.890 5 40 BFBB O=[N+]([O-])c1cccc(-c2nsnc2Cl)c1 38998634 YARCSRNYEWPLBP-UHFFFAOYSA-N 241.659 2.767 5 40 BFBB O=[N+]([O-])c1ccc(OCc2ccco2)c(F)c1 35655593 LYQXDBGINUYTKU-UHFFFAOYSA-N 237.186 2.906 5 40 BFBB Cc1ccc2c([N+](=O)[O-])c(C)cc(F)c2n1 85399704 JJZYVQPQKKZXSC-UHFFFAOYSA-N 220.203 2.899 5 40 BFBB Cc1cc(=O)oc2ccc3ncccc3c12 85399840 QKWCTJVNRWAVQX-UHFFFAOYSA-N 211.220 2.650 5 40 BFBB C[N+]1([C@@H]2CC[C@@H]3CCC[C@@H]2C3=O)CCCCC1 100291511 RDMYHQLYZMGUBF-MELADBBJSA-N 236.379 2.765 5 40 BFBB Cc1ccc([N+](=O)[O-])cc1OC(F)F 52513993 AQWRKOXMBSXMCD-UHFFFAOYSA-N 203.144 2.505 5 40 BFBB CC(C)(C)c1cc([N+](=O)[O-])c2oc(N)nc2c1 73642828 SZBWRJZFRPCQJR-UHFFFAOYSA-N 235.243 2.616 5 40 BFBB CCc1cc([N+](=O)[O-])cc(Br)c1N 226314632 REIFAPILMYCLBO-UHFFFAOYSA-N 245.076 2.502 5 40 BFBB O=[N+]([O-])c1ccc2cc([N+](=O)[O-])ccc2c1 32252508 WKHOVPDKOUCPSY-UHFFFAOYSA-N 218.168 2.656 5 40 BFBB Cc1ccccc1OC(=O)c1ccc([N+](=O)[O-])o1 3279672 ZHJKXSMRDPJGRU-UHFFFAOYSA-N 247.206 2.715 5 40 BFBB C[N@+]1(Cc2cc(Cl)nc(Cl)c2)C=CN=C1 253589620 PCUAAXZOBZWYDI-OAHLLOKOSA-N 243.117 2.848 5 40 BFBB COc1cc(/C=C(\C)[N+](=O)[O-])c(OC)cc1C 3123555 UCHNBPYWHXIUPN-RMKNXTFCSA-N 237.255 2.650 5 40 BFBB CN(C)/C=C/c1ccc(Cl)cc1[N+](=O)[O-] 52530226 LCZWNRSELOSSFW-AATRIKPKSA-N 226.663 2.781 5 40 BFBB CCC[C@H](C)Oc1cccnc1[N+](=O)[O-] 79001408 QVSORUUINXBSOR-QMMMGPOBSA-N 210.233 2.557 5 40 BFBB Cc1cc(C)nc(Nc2ccc([N+](=O)[O-])cc2)n1 4229294 VGFMTVDNPHKQAR-UHFFFAOYSA-N 244.254 2.745 5 40 BFBB O=[N+]([O-])c1ccc(OCc2cccnc2)cc1 12395628 OZJVNSSWARSUJN-UHFFFAOYSA-N 230.223 2.569 5 40 BFBB CC(=O)[C@@H](C)c1ccc([N+](=O)[O-])c(Cl)c1 169800361 XSCYNAFCAZUMMG-ZCFIWIBFSA-N 227.647 2.941 5 40 BFBB O=[N+]([O-])c1ccc([C@H]2C[C@@]2(F)Cl)cc1 4671681 RBYIEBIWCJVVCR-BDAKNGLRSA-N 215.611 2.987 5 40 BFBB O=[N+]([O-])c1ccccc1OC(F)(F)Cl 91252302 NOXFKTUASDPYMW-UHFFFAOYSA-N 223.562 2.763 5 40 BFBB C[n+]1ccccc1/C=C\c1cccc([N+](=O)[O-])c1 17145588 WUYDGZXXFBLSTH-HJWRWDBZSA-N 241.270 2.590 5 40 BFBB C[C@H]1CCC[C@H]1OC(=O)c1ccc([N+](=O)[O-])cc1 1700421 JEPOOXKTKKVJQR-JOYOIKCWSA-N 249.266 2.940 5 40 BFBB O=C(Nc1ccccc1[N+](=O)[O-])C1CCCC1 5679638 ZHWPHJXTRKCRSI-UHFFFAOYSA-N 234.255 2.724 5 40 BFBB CC(C)(C)c1cnc(Cl)c([N+](=O)[O-])c1 96395181 FYDWBUGKMKWHDN-UHFFFAOYSA-N 214.652 2.941 5 40 BFBB in-vitro Cc1cc(NCC(C)C)ccc1[N+](=O)[O-] 35277270 ZVZQEWDAGDPBBN-UHFFFAOYSA-N 208.261 2.971 5 40 BFBB Cc1cc(C)c2cccc([N+](=O)[O-])c2n1 32235359 ACDJJRZSUBAOSM-UHFFFAOYSA-N 202.213 2.760 5 40 BFBB Cc1ccc([N+](=O)[O-])c(OCC(C)C)c1 58458846 FEHPWJCEHZPRQF-UHFFFAOYSA-N 209.245 2.938 5 40 BFBB CC[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C 4589847 BRTLNXCOEWAONG-QMMMGPOBSA-N 236.271 2.888 5 40 BFBB COc1ccc(Nc2ncccc2[N+](=O)[O-])cc1 5335390 FBRGVZQMSOPNHF-UHFFFAOYSA-N 245.238 2.742 5 40 BFBB O=[N+]([O-])c1cccc(NCc2ccco2)c1 28580559 FPHRXRZVWSAYGU-UHFFFAOYSA-N 218.212 2.800 5 40 BFBB CC(C)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 71799868 OPYXGYQNZLBNRZ-SECBINFHSA-N 248.282 2.528 5 40 BFBB Cc1noc(/C=C/Nc2ccccc2)c1[N+](=O)[O-] 100151957 WXODHMQYMTVPPB-BQYQJAHWSA-N 245.238 2.974 5 40 BFBB C[N+]1(Cc2cc(Cl)nc(Cl)c2)C=CN=C1 163063 PCUAAXZOBZWYDI-UHFFFAOYSA-N 243.117 2.848 5 40 BFBB CCOc1ccc(C(=O)CC)cc1[N+](=O)[O-] 30769086 XMRSDGKHRSKJBT-UHFFFAOYSA-N 223.228 2.586 5 40 BFBB CCOC(=O)c1cc([N+](=O)[O-])c(Cl)cc1F 35333636 RNVKCYZZDSDDLB-UHFFFAOYSA-N 247.609 2.564 5 40 BFBB O=C(O)c1ccc(-c2ccccc2)cc1[N+](=O)[O-] 47212060 WOVWEENDIKEWML-UHFFFAOYSA-N 243.218 2.960 5 40 BFBB COc1cc(Cl)c([N+](=O)[O-])cc1Cl 34129879 DVGWQGRGSAQPQJ-UHFFFAOYSA-N 222.027 2.910 5 40 BFBB COC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 96034473 UKFHWVGYCBUCQO-UHFFFAOYSA-N 223.228 2.505 5 40 BFBB C[N+]1(CCc2ccccc2)CCCCC1 1668360 VBJZOUMUEZQRLN-UHFFFAOYSA-N 204.337 2.860 5 40 BFBB N=c1c2ccccc2c2ccccc2n1O 4896372 LJOSYZZRTNGWKI-UHFFFAOYSA-N 210.236 2.511 5 40 BFBB C/C=C/C=C/C(=O)Nc1cc([N+](=O)[O-])ccc1C 9952686 GDUXOYNWJFYJJG-VNKDHWASSA-N 246.266 2.974 5 40 BFBB COc1cccc2nc3c(OC)cccc3nc12 14651212 SFNYAHCOEPIPGO-UHFFFAOYSA-N 240.262 2.800 5 40 BFBB biogenic,in-vitro COCCNc1c(C)cc([N+](=O)[O-])cc1Cl 256052650 ODQPMVZUMOETSG-UHFFFAOYSA-N 244.678 2.615 5 40 BFBB O=[N+]([O-])c1ccc2c(Cl)nc(Cl)nc2c1 39270394 GTUFSSBJSUBKFD-UHFFFAOYSA-N 244.037 2.845 5 40 BFBB in-vitro O=[N+]([O-])c1ccc(C23CC(F)(C2)C3)cc1 142730446 WLBJSBWNNGJNGN-UHFFFAOYSA-N 207.204 2.738 5 40 BFBB O=CNc1ccc2c(c1)oc(=O)c1ccccc12 1574392 XQYUNAUVCTZNMQ-UHFFFAOYSA-N 239.230 2.515 5 40 BFBB O=Cc1cccc2nc3ccccc3nc12 85390755 GRDYUWLUJYJVRO-UHFFFAOYSA-N 208.220 2.596 5 40 BFBB Cc1cc(C)[n+]2ccc3ccccc3c2n1 230347 GCUAUJNERXHCNT-UHFFFAOYSA-N 209.272 2.590 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)[C@@H]1CCC[S@]1(=O)=N2 1503350576 AHYHABFBFRUJGU-MGPLVRAMSA-N 238.268 2.543 5 40 BFBB Cn1c(-c2ccco2)nc2cc([N+](=O)[O-])ccc21 8701335 YUIMONQONYYCMS-UHFFFAOYSA-N 243.222 2.742 5 40 BFBB O=[N+]([O-])c1cccnc1SC(F)(F)F 91252861 KEYNUQOOPXWQJC-UHFFFAOYSA-N 224.163 2.602 5 40 BFBB COc1ccc2ccc([N+](=O)[O-])cc2c1 71256623 OCKUAADKTDWPFH-UHFFFAOYSA-N 203.197 2.757 5 40 BFBB CC(C)(C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 5380151 VJMXBOYVKHDVPR-UHFFFAOYSA-N 247.254 2.942 5 40 BFBB CCC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1C 4526061 RIUZOUARRRJZNJ-UHFFFAOYSA-N 242.662 2.905 5 40 BFBB Nc1ccccc1-c1ccccc1[N+](=O)[O-] 4774422 RNVKESWUUKPDJS-UHFFFAOYSA-N 214.224 2.844 5 40 BFBB Cc1cc(C)c2c(=O)c3cccc(N)c3[nH]c2c1 6733660 BUSYYNITOOQBBC-UHFFFAOYSA-N 238.290 2.880 5 40 BFBB O=[N+]([O-])c1ccccc1NCCc1cccnc1 32769981 IHVZVYLGVKYSTA-UHFFFAOYSA-N 243.266 2.644 5 40 BFBB CC(C)c1nc2ccc([N+](=O)[O-])cc2o1 96345660 BYONKDLPXKQWRD-UHFFFAOYSA-N 206.201 2.859 5 40 BFBB CC(C)CC(=O)Nc1cccc([N+](=O)[O-])c1 4016359 QNHUZFLDLNBJGY-UHFFFAOYSA-N 222.244 2.579 5 40 BFBB Cc1ccc(-c2csc(N)n2)cc1[N+](=O)[O-] 2573674 GVEJZEYQGIOTNB-UHFFFAOYSA-N 235.268 2.609 5 40 BFBB O=[N+]([O-])c1ccccc1Nc1ccncc1 3953266 VHQUELUASRQSPI-UHFFFAOYSA-N 215.212 2.733 5 40 BFBB in-vitro CC[C@]1(C)CC(=O)c2cc([N+](=O)[O-])ccc2O1 12649830 RTWGROIZFAOGSB-GFCCVEGCSA-N 235.239 2.729 5 40 BFBB O=C(c1ccccc1)[N+]12CCC(F)(CC1)CC2 68604060 XJFBYOIIQQCDNR-UHFFFAOYSA-N 234.294 2.549 5 40 BFBB CCCCOC(=O)c1cccc([N+](=O)[O-])c1 1669861 ZJNPXOPNHRBFIP-UHFFFAOYSA-N 223.228 2.552 5 40 BFBB biogenic CCn1c2cc(=O)ccc-2nc2ccccc21 4159285 LMZPSNYJVWNLHJ-UHFFFAOYSA-N 224.263 2.521 5 40 BFBB C[C@@H](Nc1ncc([N+](=O)[O-])cn1)c1ccccc1 40454344 CNROBVOPBITRPI-SECBINFHSA-N 244.254 2.558 5 40 BFBB O=C(O)c1cc(=O)c2ccc3ccccc3c2o1 11567740 HEVFZDFQEDIUBI-UHFFFAOYSA-N 240.214 2.644 5 40 BFBB C[C@@H]1Cc2cc3c(c([N+](=O)[O-])c2C1)CCC3 2113474298 MAODTMDZZYRTLL-MRVPVSSYSA-N 217.268 2.818 5 40 BFBB O=Cc1ccc2nc3ccccc3nc2c1 4088074 PMZHOEAOCLBADK-UHFFFAOYSA-N 208.220 2.596 5 40 BFBB COc1cc(C)c(Cl)c(C)c1[N+](=O)[O-] 82595791 FMEXNRIQJLIDRR-UHFFFAOYSA-N 215.636 2.874 5 40 BFBB CC[C@H](C)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5250312 GMXQFXLQBAAKFN-ZETCQYMHSA-N 239.231 2.713 5 40 BFBB CCCCCc1ccc(N)cc1[N+](=O)[O-] 71404326 SKUKJVSJRNTRRP-UHFFFAOYSA-N 208.261 2.910 5 40 BFBB Cc1ccc2c(F)ccc([N+](=O)[O-])c2n1 85399548 UCCVDVYXBPROQE-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB Cc1cnc(CNc2ccc([N+](=O)[O-])c(C)c2)o1 92662902 JYTWODSAQQRAAH-UHFFFAOYSA-N 247.254 2.812 5 40 BFBB O=[N+]([O-])c1ccc2c(O)nc(Cl)cc2c1 95630971 NBYKZZQGZDHPCB-UHFFFAOYSA-N 224.603 2.502 5 40 BFBB CCc1cnc(Cl)c([N+](=O)[O-])c1Cl 225739885 NSPDKLHUHGVILO-UHFFFAOYSA-N 221.043 2.859 5 40 BFBB C[C@@H]1CCC[C@H]1OC(=O)c1ccc([N+](=O)[O-])cc1 1700422 JEPOOXKTKKVJQR-BXKDBHETSA-N 249.266 2.940 5 40 BFBB Cc1cc2c(c(C)n1)c(=O)oc1ccccc12 5537963 MLWSBGKBZWKDEM-UHFFFAOYSA-N 225.247 2.958 5 40 BFBB Cc1cc(F)cc([N+](=O)[O-])c1Br 97447195 JJYQADGOVHRHAY-UHFFFAOYSA-N 234.024 2.805 5 40 BFBB in-vitro O=c1scc(-c2ccc([N+](=O)[O-])cc2)s1 1743802 KGMIAMWJADHAOQ-UHFFFAOYSA-N 239.277 2.745 5 40 BFBB Nc1cccc(Oc2ccccc2)c1[N+](=O)[O-] 59956605 NCYDKALUEOLSFQ-UHFFFAOYSA-N 230.223 2.969 5 40 BFBB CC(C)(C)c1noc(-c2ccccc2[N+](=O)[O-])n1 75138173 YUAFAJRACUMAGJ-UHFFFAOYSA-N 247.254 2.942 5 40 BFBB CCNc1cc(Cl)ccc1[N+](=O)[O-] 4696356 QMFQYYIBSAMINA-UHFFFAOYSA-N 200.625 2.680 5 40 BFBB O=[N+]([O-])c1cc2ncccc2c2ncccc12 4830689 RGHQNGVMKBYEOZ-UHFFFAOYSA-N 225.207 2.691 5 40 BFBB Nc1cc2c(cc1[N+](=O)[O-])-c1cccc(F)c1C2 5495421 GLPBVQMOABLMNS-UHFFFAOYSA-N 244.225 2.887 5 40 BFBB Nc1cc(Oc2ccc([N+](=O)[O-])cc2F)ccn1 59822321 ARWPYOZMCQGHQS-UHFFFAOYSA-N 249.201 2.503 5 40 BFBB O=[N+]([O-])c1ccc(-c2ccncc2)cc1F 47213530 LTNLMMRTLSMHNZ-UHFFFAOYSA-N 218.187 2.796 5 40 BFBB Cc1nc(-c2ccc([N+](=O)[O-])cc2)[nH]c1C 64864694 CQKXBPFGEVYAJN-UHFFFAOYSA-N 217.228 2.602 5 40 BFBB Nc1ccccc1CCc1ccccc1[N+](=O)[O-] 98209903 FYCNYPXCTFCCDR-UHFFFAOYSA-N 242.278 2.962 5 40 BFBB CCCC[N+]1(CCC(=O)OCC)CCCCC1 5421335 DUAMDALAAOTGAR-UHFFFAOYSA-N 242.383 2.740 5 40 BFBB O=[N+]([O-])c1ccc(NCCc2ccc[nH]2)cc1 95985528 ONSIMPUVQDXIKU-UHFFFAOYSA-N 231.255 2.578 5 40 BFBB O=[N+]([O-])c1ccc2nc(-c3cccnc3)[nH]c2c1 13118287 IIIXDDOCSBCSNQ-UHFFFAOYSA-N 240.222 2.533 5 40 BFBB CC(F)(F)COc1ccc([N+](=O)[O-])cc1 1083811737 KAQSPPHBLWGBOG-UHFFFAOYSA-N 217.171 2.629 5 40 BFBB O=[N+]([O-])c1c[nH]nc1-c1ccccc1Cl 42415183 FPUCTTUTEIFUTD-UHFFFAOYSA-N 223.619 2.638 5 40 BFBB Nc1ccccc1CNc1ccccc1[N+](=O)[O-] 43828232 NSOUJOMXGTXCKD-UHFFFAOYSA-N 243.266 2.789 5 40 BFBB CC[n+]1cccc2ccc3cccnc3c21 307867 LZQWNRYBMMECOQ-UHFFFAOYSA-N 209.272 2.695 5 40 BFBB CCCCC[C@H](C)n1ccc([N+](=O)[O-])n1 71978613 PXWBUTBVEHMOCK-VIFPVBQESA-N 211.265 2.933 5 40 BFBB CCOC(=O)/C=C(/C)c1ccc([N+](=O)[O-])cc1 17039631 GXKAVJLXZLKIAJ-HJWRWDBZSA-N 235.239 2.561 5 40 BFBB C[C@@H]1CC(C)(C)O[C@@H](C[N+]2(C)CCCCC2)O1 4184832 VUXRJJNWKQSEAV-OLZOCXBDSA-N 242.383 2.547 5 40 BFBB O=C(c1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 2392563 XCFRMFKYPCTVCA-UHFFFAOYSA-N 245.209 2.965 5 40 BFBB CCOCCn1ccc2c([N+](=O)[O-])cccc21 96007420 SZCACPXMSKBVOT-UHFFFAOYSA-N 234.255 2.586 5 40 BFBB Oc1ccc2cc3ccc(O)cc3nc2c1 5161805 LXFYIIKDJZNGST-UHFFFAOYSA-N 211.220 2.799 5 40 BFBB biogenic O=[N+]([O-])[C@H]1CC=CC[C@H]1c1ccccc1 1561811 UXWVJBRZRRCUHU-RYUDHWBXSA-N 203.241 2.766 5 40 BFBB CCOc1ccc2c(c1)nc1ccccc1[n+]2C 5700978 KKLFKSZQUKTMFI-UHFFFAOYSA-N 239.298 2.611 5 40 BFBB O=C(OCc1ccccc1)c1ccc([N+](=O)[O-])o1 3232989 YZMDGRGKHFIBLH-UHFFFAOYSA-N 247.206 2.545 5 40 BFBB O=[N+]([O-])c1ccc(-c2cccnc2)cc1F 47213527 OSRAEPDZOMIARD-UHFFFAOYSA-N 218.187 2.796 5 40 BFBB O=[N+]([O-])c1ccc(-c2ncc3ccccn23)s1 8717016 UWSXKXYLIOWVGI-UHFFFAOYSA-N 245.263 2.971 5 40 BFBB O=[N+]([O-])c1ccc2nc(N3CCCC3)sc2c1 66709 FKAKUGJMKRLVJR-UHFFFAOYSA-N 249.295 2.805 5 40 BFBB Nc1cccc2c(=O)c3cccc(Cl)c3[nH]c12 6733658 DBLGQYKZJAGWQA-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB CCOC(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 26508322 MVJYOMACZVOFAS-UHFFFAOYSA-N 243.646 2.733 5 40 BFBB Cc1cc(-c2cccc([N+](=O)[O-])c2)ccn1 38890827 DWWATEVVFBMVDA-UHFFFAOYSA-N 214.224 2.965 5 40 BFBB Cc1nn(C)c(S[C@@H](C)C(C)C)c1[N+](=O)[O-] 78588941 KUULLOQCDDCTAJ-QMMMGPOBSA-N 243.332 2.773 5 40 BFBB Nc1cc([N+](=O)[O-])ccc1Nc1ccc(O)cc1 4558887 GHAWCFLBCAMCRI-UHFFFAOYSA-N 245.238 2.626 5 40 BFBB O=[N+]([O-])c1ccccc1[S@@](=O)c1ccccc1 5888945 UQDQXWRDAPUTAL-QGZVFWFLSA-N 247.275 2.762 5 40 BFBB OCc1c2ccccc2c(CO)c2ccccc12 33994544 BYSYUYRPTYENND-UHFFFAOYSA-N 238.286 2.978 5 40 BFBB COC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 5449672 WFFHFIBOJVZYJD-UHFFFAOYSA-N 247.206 2.641 5 40 BFBB O=[N+]([O-])c1cnccc1NC1CCCCC1 20188902 CORWJUKXATVWNW-UHFFFAOYSA-N 221.260 2.734 5 40 BFBB Cc1cc(Cl)nc(N2CCCC2)c1[N+](=O)[O-] 114411741 MROHSPXAAHOXFO-UHFFFAOYSA-N 241.678 2.552 5 40 BFBB CCOc1ccc(Cl)cc1/C=C\[N+](=O)[O-] 6000170 ZTYPLSGMANYUGH-WAYWQWQTSA-N 227.647 2.986 5 40 BFBB O=[N+]([O-])c1c(F)cccc1OCC(F)(F)F 54268891 ULRAGZQEWMUOOP-UHFFFAOYSA-N 239.124 2.675 5 40 BFBB CCCCNc1nn(C(C)C)cc1[N+](=O)[O-] 95098516 VGYQJRWEDVEIAD-UHFFFAOYSA-N 226.280 2.584 5 40 BFBB O=[N+]([O-])c1ccc(C(F)(F)C(F)(F)F)nc1 169803978 SGBJMWRQBJPTSN-UHFFFAOYSA-N 242.103 2.644 5 40 BFBB O=[N+]([O-])[C@@H]1CCCC[C@H]1c1ccccc1 4900463 JPUJWHOKGSAARG-NWDGAFQWSA-N 205.257 2.990 5 40 BFBB CCOC(=O)c1cc2cccc([N+](=O)[O-])c2o1 34203549 DNLGXQWVQMTGSG-UHFFFAOYSA-N 235.195 2.518 5 40 BFBB C[C@H]1CCCCN1c1ccc([N+](=O)[O-])cc1N 52840043 CCLQBIFICDPWRA-VIFPVBQESA-N 235.287 2.556 5 40 BFBB CC(C)OCCN(C)c1sccc1[N+](=O)[O-] 96492822 QOHRAIZQCPSWMR-UHFFFAOYSA-N 244.316 2.518 5 40 BFBB Cc1[nH]c2ccc([N+](=O)[O-])cc2c(=O)c1C(C)C 685938145 KRZOBJKSTVGDDF-UHFFFAOYSA-N 246.266 2.868 5 40 BFBB Cc1cc(C)nc(Oc2cccc([N+](=O)[O-])c2)n1 377360 HQQHEKIIMIFQLX-UHFFFAOYSA-N 245.238 2.794 5 40 BFBB CCC[C@]1([N+](C)(C)C)CS[C@@H]1CC 1873896 DBTVVWUOYRIQLT-MNOVXSKESA-N 202.387 2.757 5 40 BFBB CC[C@@H](C)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 3173418 CMVYGVLBLBVTHB-QROSGCPLSA-N 248.282 2.523 5 40 BFBB C[N+]1([C@@H]2CC[C@H]3CCC[C@@H]2[C@@H]3O)CCCCC1 2839291 IMXNJBZKYVFTKA-LXTVHRRPSA-N 238.395 2.557 5 40 BFBB O=[N+]([O-])c1cccc(F)c1OC(F)(F)Cl 95215569 AUWBFLUCHHPUSC-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB COc1ccc2c(Cl)c([N+](=O)[O-])cnc2c1 34483546 HOCSOOBRPRKXSA-UHFFFAOYSA-N 238.630 2.805 5 40 BFBB in-vitro Cc1nc(-c2ccccc2[N+](=O)[O-])[nH]c1C 64864688 YOYRXJRNXGYWHG-UHFFFAOYSA-N 217.228 2.602 5 40 BFBB Cc1ncsc1/C=C/c1ccc([N+](=O)[O-])cn1 84503539 OBKCXPKIFRVPQW-HWKANZROSA-N 247.279 2.925 5 40 BFBB C[C@H](Nc1ncc([N+](=O)[O-])cn1)c1ccccc1 40454342 CNROBVOPBITRPI-VIFPVBQESA-N 244.254 2.558 5 40 BFBB O=C(Nc1ccccc1[N+](=O)[O-])c1ccsc1 61997224 GKOVADZNZOJSMD-UHFFFAOYSA-N 248.263 2.909 5 40 BFBB O=[N+]([O-])c1ccc2oc(-c3cccnc3)nc2c1 327733 KLYBDXWMSUKNSH-UHFFFAOYSA-N 241.206 2.798 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1-n1cc(Cl)cn1 72334142 YJPKGQDAXYZINE-UHFFFAOYSA-N 241.609 2.573 5 40 BFBB O=c1[nH]c2c([N+](=O)[O-])cccc2c2ccccc12 8649468 PQKGWMHEHBQWIR-UHFFFAOYSA-N 240.218 2.590 5 40 BFBB Cc1c(F)cc([N+](=O)[O-])c2c1C(=O)CCC2 22007034 AINDVQADBRIJCH-UHFFFAOYSA-N 223.203 2.561 5 40 BFBB Cc1ccncc1C(=O)c1cccc([N+](=O)[O-])c1 45029009 HVABZPWEWFLDEJ-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB COc1cc([N+](=O)[O-])c2ccccc2c1 71256652 VCXGNFZQQGASMJ-UHFFFAOYSA-N 203.197 2.757 5 40 BFBB CC(=O)[C@H](C)c1ccc([N+](=O)[O-])c(Cl)c1 169800363 XSCYNAFCAZUMMG-LURJTMIESA-N 227.647 2.941 5 40 BFBB Cc1c(C2CC2)[nH]c2cccc([N+](=O)[O-])c2c1=O 685938683 ZOSRSIHKHXZDRO-UHFFFAOYSA-N 244.250 2.622 5 40 BFBB Nc1ccc(N2CCCCCC2)c([N+](=O)[O-])c1 15443304 AXCMPAWDTLJSBP-UHFFFAOYSA-N 235.287 2.557 5 40 BFBB C[C@H](O)[C@@H](C)SCc1cccc([N+](=O)[O-])c1 96430286 QLLUCUMCVWXISY-DTWKUNHWSA-N 241.312 2.597 5 40 BFBB O=C(Nc1ccccc1[N+](=O)[O-])c1cccs1 3897703 ZLXFHJJWFDLTOT-UHFFFAOYSA-N 248.263 2.909 5 40 BFBB C[C@H](Cc1ccco1)Nc1ncccc1[N+](=O)[O-] 25575569 CAXDYDANWZRRCA-SECBINFHSA-N 247.254 2.626 5 40 BFBB CCOC(=O)c1cc([N+](=O)[O-])c(F)cc1Cl 35333430 XHFJXQUWCLIYML-UHFFFAOYSA-N 247.609 2.564 5 40 BFBB CNc1nc(-c2ccccc2[N+](=O)[O-])cs1 61714278 AXVLTSPWCPQVCS-UHFFFAOYSA-N 235.268 2.760 5 40 BFBB in-vitro CCCn1c(C)nc2c([N+](=O)[O-])cc(C)cc21 1584469 BMNWYIZEDNAXCV-UHFFFAOYSA-N 233.271 2.971 5 40 BFBB O=[N+]([O-])c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 34624271 SFFULSMRSWZZNW-UHFFFAOYSA-N 236.105 2.522 5 40 BFBB CC[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1F 4524539 AKTNGEYIAZOWHJ-ZETCQYMHSA-N 240.234 2.719 5 40 BFBB CC(C)N[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 5462909 GVVMWRCBLWSEPK-JTQLQIEISA-N 222.288 2.524 5 40 BFBB Cc1oc(-c2cccc([N+](=O)[O-])c2)cc1C(=O)O 6508845 NYDVRCWYKBDUMJ-UHFFFAOYSA-N 247.206 2.861 5 40 BFBB O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccsc1 25010791 OYAVZQLKBMVEJK-UHFFFAOYSA-N 248.263 2.909 5 40 BFBB Cc1ccc(C(=O)c2ccc([N+](=O)[O-])cc2)cn1 45029077 QRXHALIQCFZRAZ-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB O=[N+]([O-])c1cccc(-c2ccncc2)c1F 47213521 BTILGGLZBVUFGB-UHFFFAOYSA-N 218.187 2.796 5 40 BFBB CC(C)(CCC(=O)c1cccs1)[N+](=O)[O-] 5632637 WZKPILNFGIEWJC-UHFFFAOYSA-N 227.285 2.766 5 40 BFBB Cc1noc(C)c1C[N+](C)(C)C1CCCC1 24156162 FZNSMYKIRWBVIR-UHFFFAOYSA-N 223.340 2.810 5 40 BFBB O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CC12CCC2 342705 OMMCEGZFWNFGLK-NSHDSACASA-N 246.266 2.724 5 40 BFBB CCCCc1sc(C=O)cc1[N+](=O)[O-] 3664486 VCLSVOIJIHQAOF-UHFFFAOYSA-N 213.258 2.811 5 40 BFBB Cc1n[nH]c(Nc2ccccc2F)c1[N+](=O)[O-] 4074192 BHSANPZGIFEZKO-UHFFFAOYSA-N 236.206 2.509 5 40 BFBB Cc1c(F)ccc([N+](=O)[O-])c1Br 64034017 PDMCCNBQQUKSMY-UHFFFAOYSA-N 234.024 2.805 5 40 BFBB O=Cc1nc2ccccc2c2ncccc12 332962 PNCCXVYVMZWAQH-UHFFFAOYSA-N 208.220 2.596 5 40 BFBB in-vitro O=[N+]([O-])c1ccc(/C=C/Br)o1 1565734 DWHDJUJHFAUWFM-ONEGZZNKSA-N 218.006 2.553 5 40 BFBB in-vitro O=c1ccc2ccc3c(=O)ccc4ccc1c2c43 1726969 YFPSDOXLHBDCOR-UHFFFAOYSA-N 232.238 2.742 5 40 BFBB in-vitro CNc1c(C)cc2nc(C)c(C)nc2c1[N+](=O)[O-] 22058111 BEBDSPSEGFJNNE-UHFFFAOYSA-N 246.270 2.505 5 40 BFBB in-vitro NCc1c2ccccc2c(CN)c2ccccc12 34584115 NNAIIURJGYYAKE-UHFFFAOYSA-N 236.318 2.910 5 40 BFBB O=[N+]([O-])c1ccc(SCc2ccncc2)nc1 5270436 YOIPPPVUWOOQQL-UHFFFAOYSA-N 247.279 2.677 5 40 BFBB CN(C)c1ccc2[nH]c(=O)c3ccccc3c2c1 16926734 OWOZMIWHTVYAAC-UHFFFAOYSA-N 238.290 2.747 5 40 BFBB O=[N+]([O-])c1ccc(/C=C/C(F)(F)F)o1 1507274 WWJFESWUIVUJLV-ONEGZZNKSA-N 207.107 2.763 5 40 BFBB O=[N+]([O-])c1ccc2nc(-c3cscn3)[nH]c2c1 12525556 LPEUFGNVMRMLRM-UHFFFAOYSA-N 246.251 2.595 5 40 BFBB in-vitro Cc1csc2nnc3c4ccccc4nc-3n12 8844786 YOTJLHQSLFBAKH-UHFFFAOYSA-N 240.291 2.752 5 40 BFBB Nc1ccc2oc3ccccc3c(=O)c2c1 4300851 JIDPRRVEJMGZKE-UHFFFAOYSA-N 211.220 2.528 5 40 BFBB in-vitro O=[N+]([O-])c1cccc(NC2CCCC2)c1 35233284 ZAYNDVNQMDINGS-UHFFFAOYSA-N 206.245 2.949 5 40 BFBB in-vitro Cc1nn(-c2ccccc2)c(Cl)c1[N+](=O)[O-] 383855 YYQDMDSWWOTGCX-UHFFFAOYSA-N 237.646 2.742 5 40 BFBB biogenic O=C1CCCCc2c1cccc2[N+](=O)[O-] 34566127 DEZYIODQPTXKAX-UHFFFAOYSA-N 205.213 2.504 5 40 BFBB O=[N+]([O-])c1ccnc2c1ccc1cccnc12 85395456 LLYHUGYRRKEIQQ-UHFFFAOYSA-N 225.207 2.691 5 40 BFBB C[C@@H](O)[C@@H](C)SCc1cccc([N+](=O)[O-])c1 96430287 QLLUCUMCVWXISY-RKDXNWHRSA-N 241.312 2.597 5 40 BFBB O=[N+]([O-])c1ccc2cn(-c3ccccc3)nc2c1 89473 OEPXXZAIQFTFHD-UHFFFAOYSA-N 239.234 2.934 5 40 BFBB Cc1ccc(C(=O)N2CCCCC2)cc1[N+](=O)[O-] 5618296 WBGNNSSZFHUHBE-UHFFFAOYSA-N 248.282 2.529 5 40 BFBB Cc1cccc(C(=O)c2cccc([N+](=O)[O-])c2)n1 45028485 NPLWAOBYBYAZHW-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB O=[N+]([O-])c1ccc(/C=C/c2ccc(O)cc2)nc1 84503338 RUDOFTPFNCTQTJ-DAFODLJHSA-N 242.234 2.866 5 40 BFBB O=[N+]([O-])c1c(Br)cccc1CF 616567704 WIKBWANXHVGEQT-UHFFFAOYSA-N 234.024 2.827 5 40 BFBB O=C(O)c1cc([N+](=O)[O-])c2c3c(cccc13)CC2 584906231 HQGCYDIIAMPZDR-UHFFFAOYSA-N 243.218 2.545 5 40 BFBB Nc1ccc2c(=O)c3ccccc3oc2c1 34410138 VKZNAWRORNRNLN-UHFFFAOYSA-N 211.220 2.528 5 40 BFBB C[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 4367253 YRGAWWJSVRCDAL-SNVBAGLBSA-N 220.272 2.831 5 40 BFBB COC(=O)c1ccc(-c2cccc([N+](=O)[O-])c2)o1 21988912 UOQVRJJYBZIWRG-UHFFFAOYSA-N 247.206 2.641 5 40 BFBB C[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 39274102 ODZVIGSMSADIHT-SNVBAGLBSA-N 220.272 2.831 5 40 BFBB CC(C)(C)NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 3159427 NOVQNLIQQIFNNS-RMKNXTFCSA-N 248.282 2.523 5 40 BFBB CCCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 4791980 PGZNBFOTVVIVJS-UHFFFAOYSA-N 242.662 2.987 5 40 BFBB Cc1ccnc(C(=O)c2ccc([N+](=O)[O-])cc2)c1 45028613 HQFXHYBPNWKXMF-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB COc1c(C=O)cc(C(C)(C)C)cc1[N+](=O)[O-] 114403595 XROXKSDWXYXAPR-UHFFFAOYSA-N 237.255 2.713 5 40 BFBB Cc1ccccc1Nc1[nH]nc(C)c1[N+](=O)[O-] 13151958 CHZNYFMSSZQZOH-UHFFFAOYSA-N 232.243 2.678 5 40 BFBB CCOCCSc1sccc1[N+](=O)[O-] 96492820 ZMSWTBZGYDJGBF-UHFFFAOYSA-N 233.314 2.785 5 40 BFBB CCOC1=Cc2ccc([N+](=O)[O-])cc2C1 1443086 BKISOZODKMTMEE-UHFFFAOYSA-N 205.213 2.528 5 40 BFBB O=[N+]([O-])c1cnccc1Nc1ccc(F)cc1 4114387 PREAJFLGPFZDCQ-UHFFFAOYSA-N 233.202 2.873 5 40 BFBB Cc1cc(=O)oc2cc3oc(=O)cc(C)c3cc12 51874 IRLAJOZCRMAKKA-UHFFFAOYSA-N 242.230 2.516 5 40 BFBB O=Cc1ccc2ccc3cccnc3c2n1 4137196 SURLLZFZRLZTBI-UHFFFAOYSA-N 208.220 2.596 5 40 BFBB O=[N+]([O-])c1ccc(OC2CC2)cc1Cl 95735640 JVGDMEISWPBNAC-UHFFFAOYSA-N 213.620 2.789 5 40 BFBB O=[N+]([O-])c1ccc(N(Cl)Cl)cc1 96347092 ZDKHHQLHSMKXJO-UHFFFAOYSA-N 207.016 2.709 5 40 BFBB C[C@H]1CNc2cc([N+](=O)[O-])ccc2S1 95644362 LYAXFLLCXIPOEN-LURJTMIESA-N 210.258 2.501 5 40 BFBB C[C@@H]1CC(C)(C)O[C@H](C[N+]2(C)CCCCC2)O1 4184827 VUXRJJNWKQSEAV-CHWSQXEVSA-N 242.383 2.547 5 40 BFBB Nc1ccc2c(c1)nc1c3ccccc3cnn21 4709880 QGSUPDVDIRBVKZ-UHFFFAOYSA-N 234.262 2.618 5 40 BFBB O=[N+]([O-])c1cc(Cl)c2nc[nH]c2c1Cl 73634810 GVSJWTOVIVXXPP-UHFFFAOYSA-N 232.026 2.778 5 40 BFBB Cc1nc(Cl)c([N+](=O)[O-])cc1Cl 98181720 XUYROFYOCGLULK-UHFFFAOYSA-N 207.016 2.605 5 40 BFBB O=[N+]([O-])c1cccnc1NCc1ccc(F)cc1 20135273 STQSEWLCSLADTG-UHFFFAOYSA-N 247.229 2.741 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1OCc1ccncc1 72209406 AYHUZWCLFUZUPM-UHFFFAOYSA-N 248.213 2.708 5 40 BFBB COCCSc1ccc([N+](=O)[O-])c(C)c1 92662678 YJAMQUGDDNNGBA-UHFFFAOYSA-N 227.285 2.642 5 40 BFBB O=[N+]([O-])c1ccc(-c2ccc(Cl)nn2)cc1 1437380 QODAYFZQLZHNPW-UHFFFAOYSA-N 235.630 2.705 5 40 BFBB CC[C@H](C)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 3173420 CMVYGVLBLBVTHB-JARNTUPDSA-N 248.282 2.523 5 40 BFBB C[C@@H]1Nc2ccc([N+](=O)[O-])cc2C1(C)C 26893553 KHQOPJVEBBOOLI-ZETCQYMHSA-N 206.245 2.686 5 40 BFBB O=[N+]([O-])c1cn[nH]c1Nc1cccc(Cl)c1 4002958 YEVDNEPLTHRILK-UHFFFAOYSA-N 238.634 2.715 5 40 BFBB Nc1c(OCc2ccccc2)cccc1[N+](=O)[O-] 5331678 SLTIDGKIYKFTSN-UHFFFAOYSA-N 244.250 2.756 5 40 BFBB Nc1cc(Cl)c2c(c1)[nH]c(=O)c1ccccc12 16951162 XHDRTQMECXEYLU-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB Cc1ccc2c(C)c(F)cc([N+](=O)[O-])c2n1 85399564 BSCGURWROVCVTM-UHFFFAOYSA-N 220.203 2.899 5 40 BFBB O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@H](F)C1 828447941 AWXWDLXBUCTXBH-QMMMGPOBSA-N 244.653 2.796 5 40 BFBB O=[N+]([O-])c1cc(Cl)c2c(c1Cl)CNCC2 63110890 QPTPFMNJFRVNGB-UHFFFAOYSA-N 247.081 2.547 5 40 BFBB Cc1c(Br)ccc(F)c1[N+](=O)[O-] 95698482 AIBRJIYOSLKVFL-UHFFFAOYSA-N 234.024 2.805 5 40 BFBB in-vitro O=[N+]([O-])[C@@H]1[C@H](c2ccccc2)[C@H]2C=C[C@H]1C2 100170096 ABLIRAIUNBLRPK-RVMXOQNASA-N 215.252 2.621 5 40 BFBB COc1c(Cl)cc(C)cc1[N+](=O)[O-] 196893730 XKPBFVAXBCMARY-UHFFFAOYSA-N 201.609 2.565 5 40 BFBB CCOc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 1404504 WKXHQWRSQSMYSH-UHFFFAOYSA-N 234.211 2.649 5 40 BFBB O=[N+]([O-])c1ccc(-c2nnc(C3CC3)o2)cc1 21003775 NLUAMFAZGDGVNR-UHFFFAOYSA-N 231.211 2.522 5 40 BFBB Cc1cc([N+](=O)[O-])ccc1NCC(C)C 36950017 VPANRLNDALAXFF-UHFFFAOYSA-N 208.261 2.971 5 40 BFBB Cc1[nH]c2c([N+](=O)[O-])cccc2c(=O)c1C(C)C 685938404 QVIDWEZAPHIHEH-UHFFFAOYSA-N 246.266 2.868 5 40 BFBB [O-][N+]1(CCc2ccccc2)CCCCC1 1688786 AWMSAHZDWMXZES-UHFFFAOYSA-N 205.301 2.728 5 40 BFBB CC(C)(OC(=O)c1ccc([N+](=O)[O-])cc1)C1CC1 1643326 DSBSIKGYHRFMIF-UHFFFAOYSA-N 249.266 2.940 5 40 BFBB O=[N+]([O-])c1ccc(CSc2ncccn2)cc1 5949432 FFTHLAUHKDHDQW-UHFFFAOYSA-N 247.279 2.677 5 40 BFBB NNCc1c2ccccc2cc2ccccc12 90613274 BLTNJHDSHFFWRF-UHFFFAOYSA-N 222.291 2.956 5 40 BFBB Cc1sc(N)nc1-c1cccc([N+](=O)[O-])c1 36379546 UCQJNHUDJFAASX-UHFFFAOYSA-N 235.268 2.609 5 40 BFBB O=c1[nH]c2ccccc2c2onc3cccc1c32 36559211 BTQSQUUABFYWPR-UHFFFAOYSA-N 236.230 2.823 5 40 BFBB O=C1c2ccccc2C([N+](=O)[O-])c2ccccc21 1671623 UWLBXNSHGLMXLU-UHFFFAOYSA-N 239.230 2.597 5 40 BFBB CSc1cc(C)nc(SC)c1[N+](=O)[O-] 34117413 VZIRTVZMIOEMFW-UHFFFAOYSA-N 230.314 2.742 5 40 BFBB CCN(CC)c1cc(N)c(Cl)cc1[N+](=O)[O-] 45891183 GGSUIVIBBKRLIL-UHFFFAOYSA-N 243.694 2.677 5 40 BFBB O=[N+]([O-])c1ccc(OC(F)(F)Cl)c(F)c1 95215772 UENXWZVEKODCJR-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB O=[N+]([O-])c1cccc(CF)c1Br 1504206535 QMHHXBHMFDUNTP-UHFFFAOYSA-N 234.024 2.827 5 40 BFBB COc1ccc2ccc3ccc(OC)nc3c2n1 13220659 YGKZOGIIRIVALS-UHFFFAOYSA-N 240.262 2.800 5 40 BFBB Cc1cc(-c2cccc([N+](=O)[O-])c2)nc(S)n1 22126589 OAVXDNXMWOKUOW-UHFFFAOYSA-N 247.279 2.649 5 40 BFBB O=C1NCc2nc3c(ccc4ccccc43)cc21 96319279 OBEXEWCWJARVFD-UHFFFAOYSA-N 234.258 2.631 5 40 BFBB O=[N+]([O-])c1ccc(F)cc1N1CCCCC1 67802459 BWMFLDMFJWXGOC-UHFFFAOYSA-N 224.235 2.724 5 40 BFBB C[C@H]1N(C)c2cc([N+](=O)[O-])ccc2C1(C)C 5393029 BYHFGPIICGZZNB-MRVPVSSYSA-N 220.272 2.711 5 40 BFBB Nc1ccc([N+](=O)[O-])cc1OCc1ccccc1 4115581 OTBQGZCBYVALOL-UHFFFAOYSA-N 244.250 2.756 5 40 BFBB Cc1ccc(C(=O)c2cccc([N+](=O)[O-])c2)cn1 45029076 JXCIWVBWKSGXOH-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB CN(C)c1cc(Cl)c(Cl)c([N+](=O)[O-])c1 71404324 DKJZBGCWKAOSCB-UHFFFAOYSA-N 235.070 2.968 5 40 BFBB CN1Cc2nc3c(ccc4ccccc43)cc2C1=O 96319276 SBRYISUKMGUQGT-UHFFFAOYSA-N 248.285 2.974 5 40 BFBB CCc1cc([N+](=O)[O-])ccc1-c1ccc(CO)o1 226314819 MEXNBVKXZWSOQC-UHFFFAOYSA-N 247.250 2.910 5 40 BFBB CCc1ccc(NC(=O)[C@H]2C[C@H]2C)cc1[N+](=O)[O-] 27317791 OZISJYPFMKWAJP-KCJUWKMLSA-N 248.282 2.752 5 40 BFBB O=Cc1cccc2cccc([N+](=O)[O-])c12 3844683 NPDJATAWFKRGIW-UHFFFAOYSA-N 201.181 2.561 5 40 BFBB biogenic COC(=O)[C@@H](C)c1ccc(Cl)c([N+](=O)[O-])c1 59649559 WMUYHRSAYZPLDU-LURJTMIESA-N 243.646 2.525 5 40 BFBB CCCn1c(S)nc2cc([N+](=O)[O-])ccc21 256053738 SQCGEQJCYUTTLI-UHFFFAOYSA-N 237.284 2.643 5 40 BFBB Cc1cc(O)c(C(C)(C)C)cc1[N+](=O)[O-] 31273421 LCIFJBVMAQCODX-UHFFFAOYSA-N 209.245 2.906 5 40 BFBB O=Cc1nc(-c2cccc([N+](=O)[O-])c2)cs1 61798348 YNPNOCDYXFLITE-UHFFFAOYSA-N 234.236 2.531 5 40 BFBB C[N+]1([C@H]2CC[C@H]3CCC[C@H]2[C@H]3O)CCCCC1 100942483 IMXNJBZKYVFTKA-KBXIAJHMSA-N 238.395 2.557 5 40 BFBB CC[C@@H](Cc1c[nH]c2ccccc12)[N+](=O)[O-] 532934 CDNXXVYBJAMWAK-JTQLQIEISA-N 218.256 2.766 5 40 BFBB Nc1cccc([N+](=O)[O-])c1OCc1ccccc1 59625181 DBSSBVGJAZKICC-UHFFFAOYSA-N 244.250 2.756 5 40 BFBB CC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5250309 GMXQFXLQBAAKFN-SSDOTTSWSA-N 239.231 2.713 5 40 BFBB CCC[C@@H](C)NC(=O)c1csc([N+](=O)[O-])c1 42567359 JNZVUADIOWYBMP-SSDOTTSWSA-N 242.300 2.575 5 40 BFBB CN(c1ccc([N+](=O)[O-])nc1)C1CCCCC1 61997449 WWQVEINKFSUMMD-UHFFFAOYSA-N 235.287 2.759 5 40 BFBB COc1ccc2[nH]c(=O)c3ccccc3c2c1 28645727 SFDHWBOPWONGJZ-UHFFFAOYSA-N 225.247 2.690 5 40 BFBB in-vitro COc1ccc2nc3cc(N)ccc3cc2c1 5141336 XWJPZQWJVGGWOG-UHFFFAOYSA-N 224.263 2.979 5 40 BFBB Cc1ccn(-c2ccc([N+](=O)[O-])cc2Cl)n1 72209584 ORQFZKKHYROFIN-UHFFFAOYSA-N 237.646 2.742 5 40 BFBB Cc1cc(-c2cscn2)c(O)c([N+](=O)[O-])c1 73281074 XQFUGTVAWCRUHU-UHFFFAOYSA-N 236.252 2.732 5 40 BFBB O=[N+]([O-])c1ccc(-n2ccc3ccccc32)nc1 582485 WGICXDURRAWOGS-UHFFFAOYSA-N 239.234 2.934 5 40 BFBB COc1cccc2oc3ccccc3c(=O)c12 5734219 IVWOUZKNCGFRBC-UHFFFAOYSA-N 226.231 2.955 5 40 BFBB Cc1cnn(-c2ccc(Cl)cc2[N+](=O)[O-])c1 12396613 OEXZMZBIRWMTKA-UHFFFAOYSA-N 237.646 2.742 5 40 BFBB O=[N+]([O-])c1ccccc1N1CCC2(CC1)CC2 1772715129 DVBYIKUHDALRDJ-UHFFFAOYSA-N 232.283 2.975 5 40 BFBB C[N+](C)(C)[C@H](c1ccccc1)C1(O)CCCC1 1713498 PWBILUCXMGNMDX-CQSZACIVSA-N 234.363 2.739 5 40 BFBB C[N+](C)(C)[C@@H](c1ccccc1)C1(O)CCCC1 6519623 PWBILUCXMGNMDX-AWEZNQCLSA-N 234.363 2.739 5 40 BFBB NCc1ccccc1Oc1ccc([N+](=O)[O-])cc1 38080313 HKJGBEUGLWZKMA-UHFFFAOYSA-N 244.250 2.846 5 40 BFBB C[C@@H]1CCCCN1c1ccc([N+](=O)[O-])cc1N 52840042 CCLQBIFICDPWRA-SECBINFHSA-N 235.287 2.556 5 40 BFBB CC[C@@H](Sc1ccccc1[N+](=O)[O-])[N+](=O)[O-] 1733901 HIIWNXDQAASFMQ-SECBINFHSA-N 242.256 2.700 5 40 BFBB CCOC(=O)c1cc(Cl)cc([N+](=O)[O-])c1C 168980984 DJHPMCNTHPTVMA-UHFFFAOYSA-N 243.646 2.733 5 40 BFBB CC(C)c1nc2cc([N+](=O)[O-])ccc2o1 199745482 WHDTWTGRAXUEGQ-UHFFFAOYSA-N 206.201 2.859 5 40 BFBB O=[N+]([O-])C1c2ccccc2Cc2ccccc21 26504101 CJKPQVQXHVEPSI-UHFFFAOYSA-N 225.247 2.957 5 40 BFBB O=c1c2ccccc2oc2cc([N+](=O)[O-])ccc12 39366991 IBWXTTBDPPVWDV-UHFFFAOYSA-N 241.202 2.854 5 40 BFBB O=[N+]([O-])c1ccc(SC2CCOCC2)cc1 91505225 BJWBZYXDQSEWMO-UHFFFAOYSA-N 239.296 2.866 5 40 BFBB O=C1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1 8627474 MNSJCNRFDNFFBF-LLVKDONJSA-N 234.255 2.518 5 40 BFBB O=C(c1ccc(O)cc1)c1cccc([N+](=O)[O-])c1 71245513 JWUQLABOVXZFGZ-UHFFFAOYSA-N 243.218 2.531 5 40 BFBB O=[N+]([O-])c1ccccc1N1CCC(F)CC1 79031733 BLFUUIKTQWJSMD-UHFFFAOYSA-N 224.235 2.533 5 40 BFBB CCC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 37222469 ITLGTJHZIOBAGX-UHFFFAOYSA-N 218.212 2.669 5 40 BFBB O=[N+]([O-])c1cc2c3c(cccc3c1F)CC2 85391074 JISKSIZPIBJGMY-UHFFFAOYSA-N 217.199 2.986 5 40 BFBB Cc1cc([N+](=O)[O-])c(N)cc1N1CCC[C@@H](C)C1 216863473 HFZPANOCCLCWQS-SECBINFHSA-N 249.314 2.722 5 40 BFBB O=[N+]([O-])c1ccc(F)cc1OC(F)(F)Cl 95215709 IYNLDAOQJFTCLO-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB O=[N+]([O-])c1cnc(Oc2ccccc2)s1 17117837 URFRKRPMZAUSRK-UHFFFAOYSA-N 222.225 2.844 5 40 BFBB O=[N+]([O-])/C=C/c1cccn1-c1ccccc1 34100703 UHRORSYFELQLTP-CSKARUKUSA-N 214.224 2.725 5 40 BFBB Cc1ccc(C(=O)c2cccc([N+](=O)[O-])c2)nc1 45028549 WORVJSYJMIZYRK-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB C[C@@]1(F)Cc2cc3c(c([N+](=O)[O-])c2C1=O)CCC3 2049305483 JRNKCMLBLMQWCY-CYBMUJFWSA-N 249.241 2.551 5 40 BFBB Cc1ccc(C)c(Cn2cc(C)c([N+](=O)[O-])n2)c1 281207515 PWNVLUPQAZJUAL-UHFFFAOYSA-N 245.282 2.765 5 40 BFBB O=[N+]([O-])c1cccc(-c2csc3[n+]2CCC3)c1 161787 FNZWKXXUGHESNT-UHFFFAOYSA-N 247.299 2.557 5 40 BFBB O=[N+]([O-])Cc1ccc(Cl)c(Cl)c1 84916735 XMZBTQCHFSXKNI-UHFFFAOYSA-N 206.028 2.770 5 40 BFBB CCOC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1 1670906 HGHMFBRPCGVCGM-UHFFFAOYSA-N 244.634 2.817 5 40 BFBB CC(C)Oc1nc2ccc([N+](=O)[O-])cc2s1 3260367 XYJMTUIOBUOVNI-UHFFFAOYSA-N 238.268 2.992 5 40 BFBB Cc1c(C2CC2)[nH]c2c([N+](=O)[O-])cccc2c1=O 685938468 UBBMDSUBYSIKIP-UHFFFAOYSA-N 244.250 2.622 5 40 BFBB Cc1cc([N+](=O)[O-])c2cccnc2c1F 85399639 NHOIZLREUDEQIP-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1ccccc1 67799834 AEPNKQKENDAHPF-JTQLQIEISA-N 231.255 2.595 5 40 BFBB Nc1cc(-c2cccs2)ccc1[N+](=O)[O-] 71789989 AVLRTOLFIYWLBH-UHFFFAOYSA-N 220.253 2.906 5 40 BFBB C[N+](C)(C)[C@@]12CCCCC[C@@H]1SC2 5574525 BJUOZXBHRNHPCL-WDEREUQCSA-N 200.371 2.511 5 40 BFBB Cc1ccc(C)c(Oc2c([N+](=O)[O-])ncn2C)c1 8308962 ARZWYRJPTBSPPI-UHFFFAOYSA-N 247.254 2.737 5 40 BFBB Cc1nc(Cl)cc(Cl)c1[N+](=O)[O-] 5378134 QLHLRJUPEKKBBN-UHFFFAOYSA-N 207.016 2.605 5 40 BFBB O=[N+]([O-])c1ccc(NC[C@H]2CCC=CO2)cc1 50268565 ZPGTVDFZHMXGNP-GFCCVEGCSA-N 234.255 2.699 5 40 BFBB c1ccc2cc3c(cc2c1)C[N+]1(CCOCC1)C3 206961 SWVLQYQRBDIJGX-UHFFFAOYSA-N 240.326 2.700 5 40 BFBB Oc1c2ccccc2nc2nc3ccccc3n12 465321 OUEPGGSDGCEEOQ-UHFFFAOYSA-N 235.246 2.741 5 40 BFBB CC[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C 4589843 BRTLNXCOEWAONG-MRVPVSSYSA-N 236.271 2.888 5 40 BFBB Cc1nc2cc(C)c([N+](=O)[O-])cc2s1 45235816 VKUGPJOZBQQKCJ-UHFFFAOYSA-N 208.242 2.821 5 40 BFBB CC(=O)OCCC/C(=C\c1ccccc1)[N+](=O)[O-] 4963499 VLJSJHMJSBHITE-JLHYYAGUSA-N 249.266 2.648 5 40 BFBB O=Cc1ccccc1Oc1ncccc1[N+](=O)[O-] 14988071 XLKISLYZRCKBEW-UHFFFAOYSA-N 244.206 2.595 5 40 BFBB O=[N+]([O-])[C@H]1[C@H]2CC[C@H](C2)[C@@H]1c1ccccc1 1561971 XLJNFVWRSYMVKN-VOAKCMCISA-N 217.268 2.845 5 40 BFBB O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1F 39216259 WVVGJJXQPIOHNV-UHFFFAOYSA-N 245.209 2.965 5 40 BFBB Cc1cccc([N+](=O)[O-])c1N1CCCCC1 141682560 CRQDSPVPDUZGNZ-UHFFFAOYSA-N 220.272 2.894 5 40 BFBB CCc1ccc(NC(=O)C2CCC2)cc1[N+](=O)[O-] 32796314 KHTMAIZYIBCLQX-UHFFFAOYSA-N 248.282 2.896 5 40 BFBB CC(=O)Nc1cc(C(C)(C)C)ccc1[N+](=O)[O-] 19872835 OVGNFIPGHWFLOX-UHFFFAOYSA-N 236.271 2.851 5 40 BFBB O=[N+]([O-])c1cnn(C/C=C/c2ccccc2)c1 58655835 VVYAXTAUAUBTED-QPJJXVBHSA-N 229.239 2.505 5 40 BFBB CC(C)(C)OCCOc1cccc([N+](=O)[O-])c1 65233463 AGHKPOXEOZKECV-UHFFFAOYSA-N 239.271 2.789 5 40 BFBB C[N+]1([C@@H]2CC[C@H]3CCC[C@@H]2C3=O)CCCCC1 4950494 RDMYHQLYZMGUBF-HZSPNIEDSA-N 236.379 2.765 5 40 BFBB NCCCc1cccc2nc3ccccc3nc12 85390737 ZCBDFDKJFGFBME-UHFFFAOYSA-N 237.306 2.674 5 40 BFBB COc1cc([N+](=O)[O-])c2nc(Cl)ccc2c1 1705045 XKYYWFGJCJNRGZ-UHFFFAOYSA-N 238.630 2.805 5 40 BFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)C(C)(C)C 5618189 IMSCEKTXLVRZRS-UHFFFAOYSA-N 236.271 2.888 5 40 BFBB O=[N+]([O-])c1ccc(OC2CCC2)cc1F 238640164 FPAQMKPMSPLQLK-UHFFFAOYSA-N 211.192 2.665 5 40 BFBB O=[N+]([O-])C1=Cc2ccccc2O[C@H]1C(F)(F)F 6658051 BGTJUOYBNMSGRC-SECBINFHSA-N 245.156 2.628 5 40 BFBB CCCCOc1c(C)cc([N+](=O)[O-])cc1C=O 225272623 QCNNZVNPVBCTFW-UHFFFAOYSA-N 237.255 2.895 5 40 BFBB Cc1cccc(OC(F)(F)F)c1[N+](=O)[O-] 308581209 YALCBKRTRYCOCJ-UHFFFAOYSA-N 221.134 2.802 5 40 BFBB O=c1c2ccccc2[nH]c2cccc([N+](=O)[O-])c12 5011169 FJNZOTVFXOADDQ-UHFFFAOYSA-N 240.218 2.590 5 40 BFBB Cc1cccc(Nc2[nH]nc(C)c2[N+](=O)[O-])c1 13151805 WTPOMZKVZLWDAL-UHFFFAOYSA-N 232.243 2.678 5 40 BFBB CCOC(=O)C(C)(C)C1([N+](=O)[O-])CCCCC1 2141632 PTUDXYCDCPMPOQ-UHFFFAOYSA-N 243.303 2.555 5 40 BFBB C[N+](C)(C)C[C@@H]1CCCc2ccccc2C1=O 6482970 PRDRPTLZIYOOFW-ZDUSSCGKSA-N 232.347 2.528 5 40 BFBB CC(C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 54363743 LTVHBAAEOISYMR-UHFFFAOYSA-N 233.227 2.768 5 40 BFBB CCCCC[C@@H](C)n1cc([N+](=O)[O-])cn1 67800405 HKENSBZQLNFAIK-SECBINFHSA-N 211.265 2.933 5 40 BFBB O=[N+]([O-])c1ccc(-c2ncc3ccccn23)cc1 145307 BYQQHGNPRCWMHR-UHFFFAOYSA-N 239.234 2.910 5 40 BFBB CCSCC(=O)c1cccc([N+](=O)[O-])c1 37353256 OAEKDEWOSGBGSH-UHFFFAOYSA-N 225.269 2.531 5 40 BFBB CCCc1nc2c([N+](=O)[O-])cccc2o1 15020399 RFNYHMIDCHJYAU-UHFFFAOYSA-N 206.201 2.689 5 40 BFBB Cc1ccsc1CNc1ncccc1[N+](=O)[O-] 26730580 XHAHCARNSDNFPI-UHFFFAOYSA-N 249.295 2.972 5 40 BFBB O=CNc1ccc2oc(=O)c3ccccc3c2c1 1574391 TVKSEYYYSDLRKT-UHFFFAOYSA-N 239.230 2.515 5 40 BFBB Cc1cc([N+](=O)[O-])c(C(C)(C)C)cc1N 4115591 MAHBSOQXANQFSG-UHFFFAOYSA-N 208.261 2.783 5 40 BFBB CCC(CC)N(C)c1ccc([N+](=O)[O-])cn1 76093017 TVJNJGKGANJWJU-UHFFFAOYSA-N 223.276 2.615 5 40 BFBB CN(C)c1ccc([N+](=O)[O-])cc1C(C)(C)C 4115612 GZVLIRYVDJOPEQ-UHFFFAOYSA-N 222.288 2.958 5 40 BFBB O=[N+]([O-])c1ccc(Nc2ccncc2)cc1 5103457 JOKLFEDBHGTZLZ-UHFFFAOYSA-N 215.212 2.733 5 40 BFBB O=[N+]([O-])c1ccc(N[C@H]2CC=CCC2)nc1 80120467 FXOLTOXNKHSSQG-VIFPVBQESA-N 219.244 2.510 5 40 BFBB CCC(C)(C)OC(=O)c1ccc([N+](=O)[O-])cc1 1669865 VMRWBQDKXGUSOY-UHFFFAOYSA-N 237.255 2.940 5 40 BFBB COC(=O)c1c(C)c(C)c([N+](=O)[O-])c(C)c1C 3847164 BIEPEGACSUMBKV-UHFFFAOYSA-N 237.255 2.615 5 40 BFBB biogenic Cc1ccc2c(ccc3nccc(O)c32)n1 218259844 YMACPHAOPFIBMK-UHFFFAOYSA-N 210.236 2.797 5 40 BFBB CCOc1ccc(-n2cccc2)cc1[N+](=O)[O-] 226245033 NATNJDIABTUWOH-UHFFFAOYSA-N 232.239 2.784 5 40 BFBB CC(=O)c1ccc([N+](=O)[O-])cc1Br 5167602 GDJSHDDCLWALGA-UHFFFAOYSA-N 244.044 2.560 5 40 BFBB CC[N+](C)(CC)[C@@H](C)c1ccc(C(=O)OC)o1 507415 ACKMZFXYIWENHQ-JTQLQIEISA-N 240.323 2.614 5 40 BFBB O=c1oc2ccccc2c2ccc([N+](=O)[O-])cc12 136741922 KSBJESVKJWHWQM-UHFFFAOYSA-N 241.202 2.854 5 40 BFBB C[C@H](Nc1ncccc1[N+](=O)[O-])c1ccccn1 23642350 ZCFHDUZZKAHEHD-VIFPVBQESA-N 244.254 2.558 5 40 BFBB CCc1cc([N+](=O)[O-])ccc1N1CCCC1 146829711 GYBSGNUCDYHDDI-UHFFFAOYSA-N 220.272 2.757 5 40 BFBB Nc1ccc2c(c1)[nH]c(=O)c1ccc(Cl)cc12 8628111 NMYIVWNWWUOPBU-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB CC(C)CNc1ncnc2ccc([N+](=O)[O-])cc12 80109189 DEYKQQKDTYVVNM-UHFFFAOYSA-N 246.270 2.606 5 40 BFBB CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)O 37684876 FZIWBBRQFPNHAV-UHFFFAOYSA-N 241.268 2.794 5 40 BFBB O=[N+]([O-])c1ccc2cnc(Cl)cc2c1 95628497 PFBVXFDZOZBWJU-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB in-vitro O=[N+]([O-])c1cccnc1NCc1cccs1 20135284 FXDAEWOXEHMLTC-UHFFFAOYSA-N 235.268 2.663 5 40 BFBB CC(C)(C)C(=O)Oc1cccc([N+](=O)[O-])c1 142342757 SDFQKEYHIXNETB-UHFFFAOYSA-N 223.228 2.546 5 40 BFBB CNC(=O)c1cc2ccccc2c2cccnc12 42196944 QACDHZUYFLVDJS-UHFFFAOYSA-N 236.274 2.748 5 40 BFBB CCOC(=O)c1cc(F)cc([N+](=O)[O-])c1Cl 575700966 NYCIQEQJXJWZBG-UHFFFAOYSA-N 247.609 2.564 5 40 BFBB CC/C(=C\c1ccc([N+](=O)[O-])cc1)[N+](=O)[O-] 16970551 WFOBQJIBZWZLLZ-VQHVLOKHSA-N 222.200 2.622 5 40 BFBB in-vitro O=[N+]([O-])c1ncccc1OCc1ccccc1 58800990 DYEWWMLKQRTCII-UHFFFAOYSA-N 230.223 2.569 5 40 BFBB COc1cc(Cl)c(Cl)c([N+](=O)[O-])c1 59595373 KTPPCTQPGJFQHB-UHFFFAOYSA-N 222.027 2.910 5 40 BFBB O=[N+]([O-])c1ccc(-c2cccc(F)n2)cc1 91364316 PPFPFLVMKSRITF-UHFFFAOYSA-N 218.187 2.796 5 40 BFBB O=[N+]([O-])c1ccc(F)c(F)c1OC(F)(F)F 95215430 SKPBDHMQPLAWOX-UHFFFAOYSA-N 243.087 2.772 5 40 BFBB Nc1cc(C(F)(F)F)cc([N+](=O)[O-])c1Cl 2540117 DYNANBWWSGPRGV-UHFFFAOYSA-N 240.568 2.849 5 40 BFBB CCc1cc([N+](=O)[O-])ccc1Br 148506102 PUUCKBAMKMTQAE-UHFFFAOYSA-N 230.061 2.920 5 40 BFBB CN(Cc1ccccc1)c1cccnc1[N+](=O)[O-] 116881749 NWNHQAKCQSMOJN-UHFFFAOYSA-N 243.266 2.626 5 40 BFBB CCC[C@]1([N+](C)(C)C)CS[C@H]1CC 1873894 DBTVVWUOYRIQLT-QWRGUYRKSA-N 202.387 2.757 5 40 BFBB C[C@@H](Nc1ncccc1[N+](=O)[O-])c1ccccn1 23642348 ZCFHDUZZKAHEHD-SECBINFHSA-N 244.254 2.558 5 40 BFBB C/C(=C\c1cc([N+](=O)[O-])ccc1Cl)[N+](=O)[O-] 5183741 QKJSTFFICPIBAA-GQCTYLIASA-N 242.618 2.886 5 40 BFBB O=[N+]([O-])c1ccc(F)c(OC(F)(F)Cl)c1 95215584 BCVYPTGPPHQVEZ-UHFFFAOYSA-N 241.552 2.902 5 40 BFBB Cc1cc([N+](=O)[O-])c(N2CCC(C)CC2)cc1N 226262358 ORBLTOCXTJTCJX-UHFFFAOYSA-N 249.314 2.722 5 40 BFBB C[N+](C)(C)Cc1ccccc1CC1(O)CCCC1 1713500 GGWTURVAHIUWKI-UHFFFAOYSA-N 248.390 2.740 5 40 BFBB O=[N+]([O-])c1cnc2cc(F)ccc2c1Cl 34432053 DZZSBQQWHIHBAY-UHFFFAOYSA-N 226.594 2.936 5 40 BFBB Cc1cc(Oc2ccnc(N)c2)ccc1[N+](=O)[O-] 59822582 CQOMRRJWVKZXOJ-UHFFFAOYSA-N 245.238 2.673 5 40 BFBB O=[N+]([O-])c1cccc(CNCc2cccs2)c1 16399866 HOFXLHFGOQCKSV-UHFFFAOYSA-N 248.307 2.946 5 40 BFBB Cc1cnn2c1nnc1c3ccccc3ccc12 3197905 YYKOLNAKWZAKKH-UHFFFAOYSA-N 234.262 2.739 5 40 BFBB Cc1cc(F)c([N+](=O)[O-])c2cccnc12 85399655 OQEQVQMKIHOYDT-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB COc1cc(F)c(C(F)(F)F)cc1[N+](=O)[O-] 247879909 IQGKSGHJSYXIFD-UHFFFAOYSA-N 239.124 2.761 5 40 BFBB Cc1cc(=O)c2ccc3ccccc3c2[nH]1 8580364 DTKJUQZMLGXZJV-UHFFFAOYSA-N 209.248 2.990 5 40 BFBB O=[N+]([O-])c1ccc(C2N=NC(=S)N=N2)cc1 27027750 GJTBTOSPKAWTBO-UHFFFAOYSA-N 235.228 2.796 5 40 BFBB O=[N+]([O-])c1ccc2oc(-c3ccncc3)nc2c1 73642140 ZXCJCJNDWPBOSV-UHFFFAOYSA-N 241.206 2.798 5 40 BFBB O=[N+]([O-])[C@H]1[C@H]2C=C[C@@H](C2)[C@@H]1c1ccccc1 100170100 ABLIRAIUNBLRPK-CYDGBPFRSA-N 215.252 2.621 5 40 BFBB CNc1ccc([N+](=O)[O-])c(C(C)(C)C)c1 616567864 OZZMVWQJJDELJE-UHFFFAOYSA-N 208.261 2.934 5 40 BFBB O=C(C[C@H]1C=CCC1)Nc1cccc([N+](=O)[O-])c1 23324810 HALMMSDAAYVROD-JTQLQIEISA-N 246.266 2.890 5 40 BFBB O=C(O)c1cccc2c(=O)c3ccccc3oc12 4537913 OCRPZVVAUXUZID-UHFFFAOYSA-N 240.214 2.644 5 40 BFBB biogenic O=c1[nH]c2cc([N+](=O)[O-])ccc2c2ccccc12 17380300 ISLOXRTUQJQYES-UHFFFAOYSA-N 240.218 2.590 5 40 BFBB CCN(CC)c1ccc(C)cc1[N+](=O)[O-] 45958852 FAYAUOPVYHMZBW-UHFFFAOYSA-N 208.261 2.749 5 40 BFBB O=[N+]([O-])c1cc(C(F)(F)F)n(C2CCCC2)n1 72334104 FSLHCDLORCKULR-UHFFFAOYSA-N 249.192 2.925 5 40 BFBB O=[N+]([O-])c1cccc2oc(C(F)F)nc12 95917977 KHEXVNXLOQLRCI-UHFFFAOYSA-N 214.127 2.674 5 40 BFBB O=[N+]([O-])c1ccc(/C=C/c2ccnnc2)s1 96007216 INTHULBOYGJROD-OWOJBTEDSA-N 233.252 2.617 5 40 BFBB Cc1c(CS[C@H](C)CO)cccc1[N+](=O)[O-] 96430377 JVPHBFOTVAPMGE-MRVPVSSYSA-N 241.312 2.517 5 40 BFBB COc1cccc(Nc2ccc([N+](=O)[O-])cn2)c1 4409466 NKKOQVJTOACXMA-UHFFFAOYSA-N 245.238 2.742 5 40 BFBB C[C@@H]1CCC[C@@H]1OC(=O)c1ccc([N+](=O)[O-])cc1 1700424 JEPOOXKTKKVJQR-SKDRFNHKSA-N 249.266 2.940 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)nc1n2CCCCC1 4863851 QNZVMYVXYISBET-UHFFFAOYSA-N 231.255 2.671 5 40 BFBB Nc1ccc2c(c1)[nH]c(=O)c1c(Cl)cccc12 8627960 LBTZFVNZUJHRTC-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB O=[N+]([O-])c1ccc(Oc2cccc(CO)c2)cc1 89064365 QYYOLTJJYQGILF-UHFFFAOYSA-N 245.234 2.879 5 40 BFBB COc1ccc2ccc3cccc[n+]3c2c1 384108 NFYURWHHHBBLNY-UHFFFAOYSA-N 210.256 2.587 5 40 BFBB Cc1ccc(Sc2ncccc2[N+](=O)[O-])nc1 480489 KUKBHLKMWVMLHH-UHFFFAOYSA-N 247.279 2.844 5 40 BFBB N=C(Oc1ccccc1[N+](=O)[O-])c1ccccc1 17060108 MUAAOAUPRWAKMU-UHFFFAOYSA-N 242.234 2.999 5 40 BFBB C[C@H]1C[C@@H]1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 20064300 VSRXWIQZKKUECL-RCOVLWMOSA-N 222.200 2.626 5 40 BFBB O=[N+]([O-])c1ccc(-c2n[nH]c3c2CCCC3)cc1 196353634 KYLMIBVRTYEJSD-UHFFFAOYSA-N 243.266 2.864 5 40 BFBB Cc1ccn2c(=O)c3ccccc3cc2c1 3847846 SHDXETSUFCZFNT-UHFFFAOYSA-N 209.248 2.761 5 40 BFBB biogenic Cc1c(Cl)cc([N+](=O)[O-])c(O)c1Cl 6068989 VMBRJHMTAZXHES-UHFFFAOYSA-N 222.027 2.916 5 40 BFBB Cc1ccccc1CNc1ncccc1[N+](=O)[O-] 23642036 ZNNUQGGRNPYQAN-UHFFFAOYSA-N 243.266 2.910 5 40 BFBB Cc1ccccc1NC(=O)c1ccc([N+](=O)[O-])o1 374559 RVLYVGQMQZUQMZ-UHFFFAOYSA-N 246.222 2.749 5 40 BFBB O=[N+]([O-])c1ccc([N+](=O)[O-])c2ccccc12 4916677 GQBQDMFMXMUHAA-UHFFFAOYSA-N 218.168 2.656 5 40 BFBB in-vitro Cc1cc(O)c([N+](=O)[O-])c(C)c1Cl 36058018 YOTFJCRTPIJJFX-UHFFFAOYSA-N 201.609 2.571 5 40 BFBB Cc1ccc(OCc2ccccc2[N+](=O)[O-])cn1 69898053 WHJJFBXVNZWULD-UHFFFAOYSA-N 244.250 2.877 5 40 BFBB NNCc1cc2ccccc2c2ccccc12 90613281 QUAGAGIKRIEUNA-UHFFFAOYSA-N 222.291 2.956 5 40 BFBB Cn1cnc([N+](=O)[O-])c1Sc1cccs1 149933 XQHOWZXCDFTVST-UHFFFAOYSA-N 241.297 2.541 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)S(=O)c1ccccc1-2 1688628 BBSNLPXHXFJCJE-UHFFFAOYSA-N 245.259 2.742 5 40 BFBB in-vitro Cc1ccc(Nc2[nH]nc(C)c2[N+](=O)[O-])cc1C 13152318 KGOLWXKQFBCTLE-UHFFFAOYSA-N 246.270 2.987 5 40 BFBB O=Cc1ccc([N+](=O)[O-])c2ccccc12 60237538 FQEPRUKGWGZQFA-UHFFFAOYSA-N 201.181 2.561 5 40 BFBB CCc1[nH]c2c([N+](=O)[O-])cccc2c(=O)c1CC 685938001 GIFRQDMBIFGHAP-UHFFFAOYSA-N 246.266 2.561 5 40 BFBB O=[N+]([O-])c1ccc(Nc2ccc(F)cc2)nc1 4739852 OBQWTLGQUGDWCT-UHFFFAOYSA-N 233.202 2.873 5 40 BFBB CCc1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1[N+](=O)[O-] 27317778 OZISJYPFMKWAJP-GZMMTYOYSA-N 248.282 2.752 5 40 BFBB CC(F)(F)COc1ccccc1[N+](=O)[O-] 1565673174 KXHHLFOHPQLAQK-UHFFFAOYSA-N 217.171 2.629 5 40 BFBB CC(=O)Nc1sc2ccccc2c1[N+](=O)[O-] 4838685 AZHAXGVPYHWGTK-UHFFFAOYSA-N 236.252 2.768 5 40 BFBB C[C@@H]1CNc2cc([N+](=O)[O-])ccc2S1 95644361 LYAXFLLCXIPOEN-ZCFIWIBFSA-N 210.258 2.501 5 40 BFBB C/C(Br)=C\c1ccc([N+](=O)[O-])o1 32224823 HZLSBQZGGWHNLJ-SNAWJCMRSA-N 232.033 2.944 5 40 BFBB O=[N+]([O-])c1ccc(-c2noc(C(F)F)n2)cc1 36611147 HWILFGCWJOJUHU-UHFFFAOYSA-N 241.153 2.582 5 40 BFBB Cc1cc([C@H](O)c2ccccc2)ccc1[N+](=O)[O-] 226293104 BWRGTXLRXNXZNG-CQSZACIVSA-N 243.262 2.985 5 40 BFBB c1ccc(C[N+]23CCC(CC2)CC3)cc1 1649015 RDPBRXDVEIYBBL-UHFFFAOYSA-N 202.321 2.817 5 40 BFBB O=C1NC(=O)c2cc3cc4ccccc4cc3cc21 34628308 WURUEAGEEANDFN-UHFFFAOYSA-N 247.253 2.877 5 40 BFBB C[C@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 20064302 VSRXWIQZKKUECL-IMTBSYHQSA-N 222.200 2.626 5 40 BFBB CCCCOC(=O)c1ccc([N+](=O)[O-])cc1 1847781 DVTGVOHTTDVRJF-UHFFFAOYSA-N 223.228 2.552 5 40 BFBB O=[N+]([O-])c1ccccc1-n1ccc(C2CC2)n1 12397125 NIKBGYDNUBPFAO-UHFFFAOYSA-N 229.239 2.658 5 40 BFBB O=c1sc2ccccc2c(Cl)c1[N+](=O)[O-] 247605 BRGBHESOUYRHMB-UHFFFAOYSA-N 241.655 2.823 5 40 BFBB CN(Cc1ccccc1)c1ccc([N+](=O)[O-])nc1 61997473 DCEMXICRWQWGSC-UHFFFAOYSA-N 243.266 2.626 5 40 BFBB Nc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 3894635 MQDYZYVWFUIEQU-UHFFFAOYSA-N 214.224 2.844 5 40 BFBB Cc1ccc(-c2ccc(C(=O)O)o2)c([N+](=O)[O-])c1 57026 UNSSRIPGQQOYLI-UHFFFAOYSA-N 247.206 2.861 5 40 BFBB CCC(=O)Nc1c(C)cc(C)cc1[N+](=O)[O-] 72193699 HHVSNIFKWHZGRW-UHFFFAOYSA-N 222.244 2.560 5 40 BFBB C[N+]1([C@@H]2CC[C@@H]3CCC[C@@H]2[C@@H]3O)CCCCC1 2398365 IMXNJBZKYVFTKA-BYNSBNAKSA-N 238.395 2.557 5 40 BFBB Cc1cc(-c2ccc([N+](=O)[O-])cc2)nc(S)n1 22126591 WYLUKPQWYSHEQH-UHFFFAOYSA-N 247.279 2.649 5 40 BFBB C[N+]1([C@@H]2CC[C@H]3CCC[C@H]2[C@H]3O)CCCCC1 100942485 IMXNJBZKYVFTKA-TUVASFSCSA-N 238.395 2.557 5 40 BFBB O=[N+]([O-])c1ccc2c(Cl)ccnc2c1 39207170 UPZGWWDLHRREJM-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB in-vitro C[N+]1([C@H]2CC[C@@H]3CCC[C@@H]2[C@@H]3O)CCCCC1 542430 IMXNJBZKYVFTKA-ZQDZILKHSA-N 238.395 2.557 5 40 BFBB O=[N+]([O-])c1cc(Cl)ccc1OC(F)F 71791992 MTRPCOKJSDVMKS-UHFFFAOYSA-N 223.562 2.850 5 40 BFBB in-vitro Cc1c(-c2ccc(C(=O)O)o2)cccc1[N+](=O)[O-] 15417059 XFSUBJCFHQQVSJ-UHFFFAOYSA-N 247.206 2.861 5 40 BFBB COc1cc(Cl)c(/C=C/[N+](=O)[O-])cc1OC 33685132 DFIIAGUXPLLLLO-ONEGZZNKSA-N 243.646 2.605 5 40 BFBB Cc1cc(-c2ccccc2[N+](=O)[O-])no1 221268922 AHUMHWDIFMHMMK-UHFFFAOYSA-N 204.185 2.558 5 40 BFBB in-vitro O=c1[nH]c2ccccc2c2cccc(F)c12 17380283 LRUPVTWQYCNSQT-UHFFFAOYSA-N 213.211 2.820 5 40 BFBB CCc1[nH]c2ccc([N+](=O)[O-])cc2c(=O)c1CC 685938058 IDIHISOOVGWUEJ-UHFFFAOYSA-N 246.266 2.561 5 40 BFBB O=[N+]([O-])c1ccc2snc(Cl)c2c1 339039 JLKBGSBCVBKCBM-UHFFFAOYSA-N 214.633 2.858 5 40 BFBB COc1cc(-c2ccccc2)cnc1[N+](=O)[O-] 38254597 UXWPNGMIGIILCY-UHFFFAOYSA-N 230.223 2.665 5 40 BFBB C[C@@H]1CCCCN1c1ccc(N)cc1[N+](=O)[O-] 226262279 KLEUMZQUVBLPIC-SECBINFHSA-N 235.287 2.556 5 40 BFBB Cc1c(C2CC2)[nH]c2ccc([N+](=O)[O-])cc2c1=O 685938045 HNJVUGUIXUWJCW-UHFFFAOYSA-N 244.250 2.622 5 40 BFBB O=[N+]([O-])c1c(Cl)cccc1OC(F)F 2529892 OYQMMAGJQDIXMD-UHFFFAOYSA-N 223.562 2.850 5 40 BFBB O=[N+]([O-])c1ccc(/C=C/c2cccnc2)nc1 84503551 XUEICLJUWXOUBS-ONEGZZNKSA-N 227.223 2.555 5 40 BFBB Cc1ccnc2c([N+](=O)[O-])c(F)ccc12 85399519 GTFXPAFRKSEOIJ-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB Cc1c(C2CC2)[nH]c2cc([N+](=O)[O-])ccc2c1=O 685938490 VJWATJQQBLTLAS-UHFFFAOYSA-N 244.250 2.622 5 40 BFBB C/C=C\C=C/C(=O)Nc1ccc([N+](=O)[O-])cc1 8612502 FAWZPFLKIAIQCM-LDIADDGTSA-N 232.239 2.666 5 40 BFBB O=[N+]([O-])c1ccc2c(Cl)nccc2c1 82046787 HYPKTFUVDWSWBZ-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB in-vitro O=C(Nc1cccc([N+](=O)[O-])c1)c1cccs1 38818 VFDHCXRHENGDQA-UHFFFAOYSA-N 248.263 2.909 5 40 BFBB Cc1cc(C(C)(C)C)c([N+](=O)[O-])cc1C(=O)O 19801473 CEBITEVJLATTAL-UHFFFAOYSA-N 237.255 2.899 5 40 BFBB C[C@H]1Nc2ccc([N+](=O)[O-])cc2C1(C)C 26893556 KHQOPJVEBBOOLI-SSDOTTSWSA-N 206.245 2.686 5 40 BFBB Cc1cc(OC(F)F)ccc1[N+](=O)[O-] 39105204 ZMQMGYRUUZPIOD-UHFFFAOYSA-N 203.144 2.505 5 40 BFBB CCCc1ccc(NC(C)=O)c([N+](=O)[O-])c1 4289527 SXFNOCQYZBBQRC-UHFFFAOYSA-N 222.244 2.506 5 40 BFBB O=[N+]([O-])c1ccccc1-n1ncc2c1CCCC2 239562941 MTUWXCIMKYFMGI-UHFFFAOYSA-N 243.266 2.659 5 40 BFBB CC[C@](O)(c1cccc([N+](=O)[O-])c1)C(F)(F)F 43368183 NQAROGWFJFQXPU-VIFPVBQESA-N 249.188 2.755 5 40 BFBB O=C(O)c1nc2ccc(F)cc2c2ncccc12 2456139 VEBUAPCUHFQXKI-UHFFFAOYSA-N 242.209 2.620 5 40 BFBB CCCCC(=O)Nc1ccc([N+](=O)[O-])cc1 5297238 KMHYURRGBJRGNW-UHFFFAOYSA-N 222.244 2.724 5 40 BFBB Cc1c(F)cc2c(C)ccnc2c1[N+](=O)[O-] 85399606 RKINLRHRHZCXKR-UHFFFAOYSA-N 220.203 2.899 5 40 BFBB Cc1c(C(=O)OC(C)(C)C)cccc1[N+](=O)[O-] 68813108 QIWRTXBKFGYEHT-UHFFFAOYSA-N 237.255 2.859 5 40 BFBB CC(C)(C)c1cc(Cl)ncc1[N+](=O)[O-] 675081687 IFFVQMCSKUWPTF-UHFFFAOYSA-N 214.652 2.941 5 40 BFBB CC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 345893 UWZJMCNFDLBYDY-UHFFFAOYSA-N 236.271 2.851 5 40 BFBB O=[N+]([O-])c1ccc(Sc2ncccn2)cc1 1849724 VFZRGLKTZAKXCP-UHFFFAOYSA-N 233.252 2.536 5 40 BFBB Cc1ccc(OCC(F)(F)F)c([N+](=O)[O-])c1 20348942 BQURRAMFSNWEPB-UHFFFAOYSA-N 235.161 2.844 5 40 BFBB CCC[N+](CCC)(CCO)Cc1ccccc1 332340 USYQCXBVBBNHPQ-UHFFFAOYSA-N 236.379 2.816 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1NN1CCCCC1 95081453 CKCLXHVHWUNREF-UHFFFAOYSA-N 239.250 2.547 5 40 BFBB Cc1cccc(Sc2ncccc2[N+](=O)[O-])n1 481346 RCBNYDJDJGTDRY-UHFFFAOYSA-N 247.279 2.844 5 40 BFBB CC[C@@H](C)COC(=O)c1ccc([N+](=O)[O-])cc1 2042929 OPTWCGBPFYHUBZ-SECBINFHSA-N 237.255 2.798 5 40 BFBB CCNc1nc2cc([N+](=O)[O-])ccc2s1 3850853 AWBVSFMAJRSGDC-UHFFFAOYSA-N 223.257 2.636 5 40 BFBB biogenic O=[N+]([O-])c1c(NC2CCCC2)nc2ccccn12 8215917 PNYQQGZLEYBLQJ-UHFFFAOYSA-N 246.270 2.597 5 40 BFBB Cc1ccc([N+](=O)[O-])cc1C(=O)OC(C)(C)C 68813382 GUXFFXRATFGCRR-UHFFFAOYSA-N 237.255 2.859 5 40 BFBB CCc1[nH]c2cccc([N+](=O)[O-])c2c(=O)c1CC 685938246 MWNIITNVVAOFPN-UHFFFAOYSA-N 246.266 2.561 5 40 BFBB Cc1ccc(CNc2ccc([N+](=O)[O-])cn2)cc1 21516207 QGEPGVMVYBLQFV-UHFFFAOYSA-N 243.266 2.910 5 40 BFBB O=C(O)c1cccc([N+](=O)[O-])c1-c1ccccc1 35572370 CGVYXCSHRKEUQN-UHFFFAOYSA-N 243.218 2.960 5 40 BFBB CCN(C)[C@@H](C)c1ccccc1[N+](=O)[O-] 75682458 RUZMEBMKBKBBKH-VIFPVBQESA-N 208.261 2.608 5 40 BFBB C[C@H](Cn1cc([N+](=O)[O-])cn1)c1ccccc1 67799836 AEPNKQKENDAHPF-SNVBAGLBSA-N 231.255 2.595 5 40 BFBB C[N+](N)(Cc1ccccc1)Cc1ccccc1 1681694 NHFFYAONIYOMAQ-UHFFFAOYSA-N 227.331 2.707 5 40 BFBB COC(=O)c1ccc(C[N+]2(C)CCCCC2)cc1 4184537 VJADTEWNRGYKDX-UHFFFAOYSA-N 248.346 2.604 5 40 BFBB O=Cc1ccc(Oc2cccc([N+](=O)[O-])c2)o1 32256487 NCQVJXWUFGWSBA-UHFFFAOYSA-N 233.179 2.793 5 40 BFBB N[C@@H](CO)c1c2ccccc2cc2ccccc12 72198835 ZNTMTJISNMWNMS-HNNXBMFYSA-N 237.302 2.985 5 40 BFBB O=C(c1cccc([N+](=O)[O-])c1)c1ccccc1F 2392558 VTHDJBOODPAHJV-UHFFFAOYSA-N 245.209 2.965 5 40 BFBB COc1cc(OC(F)(F)F)ccc1[N+](=O)[O-] 199760963 ZNQCZJLHSDUMCM-UHFFFAOYSA-N 237.133 2.502 5 40 BFBB O=C(O)c1cc2ccc3ccccc3c2oc1=O 349877 HCZYKDRIXYWMQG-UHFFFAOYSA-N 240.214 2.644 5 40 BFBB Cc1[nH]c2ccccc2c1/C=C\[N+](=O)[O-] 6130598 DTSVTKXSWKXFDC-SREVYHEPSA-N 202.213 2.724 5 40 BFBB Cc1noc(-c2cc([N+](=O)[O-])ccc2Cl)n1 22120196 ABDPXZJSUVFDDJ-UHFFFAOYSA-N 239.618 2.607 5 40 BFBB CCOc1ccc(/C=C(\C)[N+](=O)[O-])cc1 2566686 JGHOWMIWYVZNON-CMDGGOBGSA-N 207.229 2.723 5 40 BFBB O=[N+]([O-])c1ccc(O)c(C2SCCS2)c1 35583886 FUIXIBWXXKRUDP-UHFFFAOYSA-N 243.309 2.779 5 40 BFBB C[N+]1([C@@H]2CC[C@H]3CCC[C@H]2C3=O)CCCCC1 101101381 RDMYHQLYZMGUBF-MGPQQGTHSA-N 236.379 2.765 5 40 BFBB CCOC(=O)c1cccc2cccc([N+](=O)[O-])c12 57353814 BCZFYTHTHFYBLA-UHFFFAOYSA-N 245.234 2.925 5 40 BFBB O=[N+]([O-])c1cc(C(F)(F)F)ccc1S 56704 HUJMWBOFGAQSMR-UHFFFAOYSA-N 223.175 2.902 5 40 BFBB in-vitro O=c1c2ccccc2cc2[nH]c3ccccc3n12 100119234 QHFYYHVXZTVQPY-UHFFFAOYSA-N 234.258 2.934 5 40 BFBB CC(C)(F)c1cc(F)ccc1[N+](=O)[O-] 242548287 LHZPCRVCNMYEPL-UHFFFAOYSA-N 201.172 2.939 5 40 BFBB C[N+]1(C)C[C@H]2CCC(Cl)=C(Cl)[C@@H]2C1 494846 JIIWFHHPAIWXFI-HTQZYQBOSA-N 221.151 2.792 5 40 BFBB CCN(CC)Sc1cccc([N+](=O)[O-])c1 1563332 RJBSNRVRNPOWDA-UHFFFAOYSA-N 226.301 2.944 5 40 BFBB O=[N+]([O-])c1ccc2nc(-c3ccccc3)cn2c1 20031110 GSOANPPVNYZBCL-UHFFFAOYSA-N 239.234 2.910 5 40 BFBB CCOCCSc1ccc([N+](=O)[O-])cc1F 96436782 NEEQJAHJZYLLDM-UHFFFAOYSA-N 245.275 2.863 5 40 BFBB O=[N+]([O-])c1cccc(C(F)(F)F)c1S 75629634 MSBLPDFGEHVKCZ-UHFFFAOYSA-N 223.175 2.902 5 40 BFBB Nc1nnc2c3ccccc3c3ccccc3c2n1 3217868 RRBPZBNIQKRFIZ-UHFFFAOYSA-N 246.273 2.913 5 40 BFBB CCNc1ccc([N+](=O)[O-])cc1Cl 5312180 CHKWVEBKKBNEIX-UHFFFAOYSA-N 200.625 2.680 5 40 BFBB O=[N+]([O-])c1ccc(Br)cc1CF 1504206474 IEBNZLBWRPJWFG-UHFFFAOYSA-N 234.024 2.827 5 40 BFBB CN(C)c1c(Cl)cc([N+](=O)[O-])cc1Cl 4707209 JFTBNMLPFSCIKJ-UHFFFAOYSA-N 235.070 2.968 5 40 BFBB O=C1c2ccccc2-c2cc([N+](=O)[O-])ccc21 1581019 GLVSVKSIYXDZHY-UHFFFAOYSA-N 225.203 2.806 5 40 BFBB in-vitro Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)o1 5364063 SQKVVMOSYZEZIH-UHFFFAOYSA-N 246.222 2.749 5 40 BFBB O=[N+]([O-])c1ccc2[nH]c(Br)cc2c1 85221327 XQXCBMDOCDQGSH-UHFFFAOYSA-N 241.044 2.839 5 40 BFBB O=[N+]([O-])c1ccc(CNc2ccccn2)cc1 37489184 QOLIGXABOXPTAN-UHFFFAOYSA-N 229.239 2.602 5 40 BFBB O=[N+]([O-])c1ccc(F)c(-n2cccc2)c1 2577966 QOIPFOMYLGXYDR-UHFFFAOYSA-N 206.176 2.525 5 40 BFBB O=Cc1ccc(-c2cc([N+](=O)[O-])ccc2F)o1 5756855 MGALANOOJONVRQ-UHFFFAOYSA-N 235.170 2.806 5 40 BFBB CC(C)c1nccn1Cc1ccc([N+](=O)[O-])cc1 16576039 MGUVUVANZDHXGT-UHFFFAOYSA-N 245.282 2.963 5 40 BFBB O=[N+]([O-])c1cccc(C2N=NC(=S)N=N2)c1 27027793 WGZPJSCHZZJNPH-UHFFFAOYSA-N 235.228 2.796 5 40 BFBB Nc1ccc2c(c1)[nH]c(=O)c1cccc(Cl)c12 8628112 CRQUIXNEMLINMX-UHFFFAOYSA-N 244.681 2.917 5 40 BFBB Cc1ccc(C(=O)c2ccc([N+](=O)[O-])cc2)nc1 45028550 QIDDBVLHOKHYMF-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB O=[N+]([O-])c1ccc(O)c(-c2ccccc2)c1 84191264 FIBBSIRCVZWBML-UHFFFAOYSA-N 215.208 2.967 5 40 BFBB c1ccc2c(c1)ccc1n3ccccc3c[n+]21 1685113 PIUJVDTXHYUCEM-UHFFFAOYSA-N 219.267 2.831 5 40 BFBB O=c1oc2ccc([N+](=O)[O-])cc2c2ccccc12 155873 NSXRBWUONVTXSK-UHFFFAOYSA-N 241.202 2.854 5 40 BFBB O=C(Oc1ccccc1[N+](=O)[O-])c1cccs1 383610 GPAHVISEVVHWOQ-UHFFFAOYSA-N 249.247 2.876 5 40 BFBB COc1ccc2c(c1)c(=O)oc1ccccc12 382925 KSLRTABCTJMGOS-UHFFFAOYSA-N 226.231 2.955 5 40 BFBB CC1(C)CCNc2ccc([N+](=O)[O-])cc21 199617878 SJBDPELMMKAMOC-UHFFFAOYSA-N 206.245 2.688 5 40 BFBB Cc1cccnc1-c1ccc([N+](=O)[O-])cc1 1437373 TXBBGNHDQMTWFC-UHFFFAOYSA-N 214.224 2.965 5 40 BFBB Nc1cc([N+](=O)[O-])ccc1OCc1ccccc1 1657234 VWLXPSZDHYNSRA-UHFFFAOYSA-N 244.250 2.756 5 40 BFBB c1ccc2nc3nc4ccccc4nc3nc2c1 1870415 RKOODWXAVAEOQW-UHFFFAOYSA-N 232.246 2.726 5 40 BFBB O=[N+]([O-])c1c(S)cccc1C(F)(F)F 75629633 RYLMVYVDTOCLRR-UHFFFAOYSA-N 223.175 2.902 5 40 BFBB Cc1cccc(C(=O)N2CCCCC2)c1[N+](=O)[O-] 6524432 SCRWSKMEDRBXAU-UHFFFAOYSA-N 248.282 2.529 5 40 BFBB CC(=O)Nc1ccc2c([N+](=O)[O-])cccc2c1 345660 IFWPKYVZNBTNET-UHFFFAOYSA-N 230.223 2.706 5 40 BFBB CCCCC(=O)c1cccc([N+](=O)[O-])c1 21992991 WKGSOFFWCPDKKN-UHFFFAOYSA-N 207.229 2.968 5 40 BFBB O=[N+]([O-])c1cc2c3c(cccc3c1O)CC2 36020478 SMFCLZNIYUHNNM-UHFFFAOYSA-N 215.208 2.552 5 40 BFBB COCC[C@H](C)Nc1ccc([N+](=O)[O-])cc1F 45038748 VZPZXCCHGSFRIP-QMMMGPOBSA-N 242.250 2.571 5 40 BFBB Cn1ccnc1SCc1cccc([N+](=O)[O-])c1 5642222 ULYZAKZQTLEIHX-UHFFFAOYSA-N 249.295 2.621 5 40 BFBB Cc1ncc(C)c2c([N+](=O)[O-])cccc12 13207840 WTACEYGASPOAEO-UHFFFAOYSA-N 202.213 2.760 5 40 BFBB C[N+]1([C@@H]2CC[C@H]3CCC[C@H]2[C@@H]3O)CCCCC1 101138250 IMXNJBZKYVFTKA-KBUPBQIOSA-N 238.395 2.557 5 40 BFBB CCCCCOc1ccc([N+](=O)[O-])cc1N 2187154 VADGLLRCVFKKLW-UHFFFAOYSA-N 224.260 2.746 5 40 BFBB O=C(Nc1cccc([N+](=O)[O-])c1)C1CCCC1 6331657 YOMYHKWKZLGNIO-UHFFFAOYSA-N 234.255 2.724 5 40 BFBB CC(C)(C)c1cc([N+](=O)[O-])ccc1C(=O)O 19801483 LGEBVAXTNXQOJC-UHFFFAOYSA-N 223.228 2.591 5 40 BFBB Cc1noc(/C=C\c2ccccc2O)c1[N+](=O)[O-] 5518482 TXOHTEBDEXXXME-SREVYHEPSA-N 246.222 2.767 5 40 BFBB Cc1cc(O)cc2c1c(=O)c1ccccc1n2C 5615378 VLBQIHNGBSEGKV-UHFFFAOYSA-N 239.274 2.706 5 40 BFBB CCCCNc1ccc([N+](=O)[O-])cc1C(=O)O 19844820 YUVASMCXRDPJTE-UHFFFAOYSA-N 238.243 2.505 5 40 BFBB CCOc1ccc([N+](=O)[O-])cc1C(=O)CC 96287934 ICMBZFGYAVAWQT-UHFFFAOYSA-N 223.228 2.586 5 40 BFBB O=[N+]([O-])c1ccc2oc3cccnc3c2c1 5385160 MNMYIVAXVCWSOS-UHFFFAOYSA-N 214.180 2.889 5 40 BFBB O=[N+]([O-])c1cccc(Cl)c1N1CCCC1 5799216 SHWAUCHKWGIYJA-UHFFFAOYSA-N 226.663 2.848 5 40 BFBB Cc1cccnc1Sc1ncccc1[N+](=O)[O-] 481345 HALOMPAOXMHZAB-UHFFFAOYSA-N 247.279 2.844 5 40 BFBB O=[N+]([O-])c1cc(F)c(OC(F)(F)F)c(F)c1 95215774 PYZLOTVPFYDQLW-UHFFFAOYSA-N 243.087 2.772 5 40 BFBB O=[N+]([O-])c1ccccc1-n1ncc2ccccc21 143528078 YAFJMTSNMRHSQL-UHFFFAOYSA-N 239.234 2.934 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)[C@H]1CCC[S@@]1(=O)=N2 1503350565 AHYHABFBFRUJGU-HWPZZCPQSA-N 238.268 2.543 5 40 BFBB Cc1c(C(=O)N2CCCCC2)cccc1[N+](=O)[O-] 4673481 MCDWIYYUVLIGOO-UHFFFAOYSA-N 248.282 2.529 5 40 BFBB CC[C@@H](C)Nc1nn(C(C)C)cc1[N+](=O)[O-] 95098512 RMVVHDCEMKECMI-MRVPVSSYSA-N 226.280 2.583 5 40 BFBB CC[N+](C)(CC)C/C=C\CC[N+](C)(CC)CC 1571286 CNOZHSRXPBNGPV-QXMHVHEDSA-N 242.451 2.906 5 40 BFBB CCOC(=O)c1[nH]c2c([N+](=O)[O-])cccc2c1C 174872 RHEMXLGKTCNVMU-UHFFFAOYSA-N 248.238 2.561 5 40 BFBB CN(c1cccc([N+](=O)[O-])c1)C(C)(C)C 345930 UEKWJQDGZQPUGE-UHFFFAOYSA-N 208.261 2.830 5 40 BFBB Cc1c(C)c([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 1664055 NYUTYKUIBRNYIV-UHFFFAOYSA-N 224.216 2.737 5 40 BFBB COc1cccc2oc3cc(O)ccc3c(=O)c12 4167143 UKPKWIBNYWUEMK-UHFFFAOYSA-N 242.230 2.660 5 40 BFBB biogenic O=Cc1c(Cl)cc([N+](=O)[O-])cc1Cl 71789860 FTSIAOWNUAVTHV-UHFFFAOYSA-N 220.011 2.714 5 40 BFBB CC[C@H](C)COC(=O)c1ccc([N+](=O)[O-])cc1 1699972 OPTWCGBPFYHUBZ-VIFPVBQESA-N 237.255 2.798 5 40 BFBB C[N+]1(C)CCc2cc(Br)ccc21 21672 UNZNLUNORKZMEM-UHFFFAOYSA-N 227.125 2.572 5 40 BFBB C[C@H](SCc1cccc([N+](=O)[O-])c1)[C@@H](C)O 96430289 QLLUCUMCVWXISY-BDAKNGLRSA-N 241.312 2.597 5 40 BFBB O=C1CCCC[C@@H]1[C@H](C[N+](=O)[O-])c1ccccc1 4114272 STOOUUNOLPMRGC-CHWSQXEVSA-N 247.294 2.806 5 40 BFBB OCCNc1nc2ccccc2c2ccccc12 31716641 MFQMJFDOYQXJHO-UHFFFAOYSA-N 238.290 2.792 5 40 BFBB O=[N+]([O-])c1cccc(CNCc2ccccc2)c1 4833190 DFYDXMFZQUWIFS-UHFFFAOYSA-N 242.278 2.885 5 40 BFBB Cc1cc(-c2ccc([N+](=O)[O-])cc2)no1 38951406 RFFBZGTZXSTTNK-UHFFFAOYSA-N 204.185 2.558 5 40 BFBB in-vitro CCCCC[C@@H](C)n1ccc([N+](=O)[O-])n1 71978612 PXWBUTBVEHMOCK-SECBINFHSA-N 211.265 2.933 5 40 BFBB C[N+](C)(C)c1cc(C(F)(F)F)cc(Cl)n1 91695042 GULQSPUPWDWFOZ-UHFFFAOYSA-N 239.648 2.951 5 40 BFBB O=[N+]([O-])c1ccc(NN2CCCCC2)c(F)c1 97658663 FCSPXVQUWQQANG-UHFFFAOYSA-N 239.250 2.547 5 40 BFBB Cc1ccc([N+](=O)[O-])c(F)c1Br 306493338 YWOQZKQYGMTCSX-UHFFFAOYSA-N 234.024 2.805 5 40 BFBB CC(=O)Nc1cccc2cccc([N+](=O)[O-])c12 312337 IKEKTISCJGFGKX-UHFFFAOYSA-N 230.223 2.706 5 40 BFBB CC(C)COc1ccc([N+](=O)[O-])cc1F 60807137 SCXYJAOMECWNQX-UHFFFAOYSA-N 213.208 2.769 5 40 BFBB O=[N+]([O-])c1ccc(OCc2ccncc2)cc1 12395585 CKJGMKQACZUWAG-UHFFFAOYSA-N 230.223 2.569 5 40 BFBB O=[N+]([O-])c1cc2[nH]ccc2cc1Br 3165576 PPXAIJGGCHQXBC-UHFFFAOYSA-N 241.044 2.839 5 40 BFBB O=Cc1ccc(N2CCCCCC2)c([N+](=O)[O-])c1 9239668 JXZJESMQISSTRZ-UHFFFAOYSA-N 248.282 2.788 5 40 BFBB c1ccc(CC[N+]23CCC(CC2)CC3)cc1 45221768 VWYUFNLVGSBWEI-UHFFFAOYSA-N 216.348 2.860 5 40 BFBB Cc1ccc([N+](=O)[O-])c(Sc2ccncc2)n1 95977463 JXJUHTWUPWVIHG-UHFFFAOYSA-N 247.279 2.844 5 40 BFBB O=C(c1cccs1)c1ccccc1[N+](=O)[O-] 1689972 MTOAODHENYKFNS-UHFFFAOYSA-N 233.248 2.887 5 40 BFBB Cc1ccc2nc3c(C(=O)O)cccc3nc2c1 6745359 YOZYLUDVFLLAAY-UHFFFAOYSA-N 238.246 2.790 5 40 BFBB O=[N+]([O-])c1cccc(-c2ccc(Cl)nn2)c1 11567908 LRAQNZJWWRMXFF-UHFFFAOYSA-N 235.630 2.705 5 40 BFBB CC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C 345891 TVCXZVZAHNKCIK-UHFFFAOYSA-N 236.271 2.851 5 40 BFBB Cc1cc(SCCN(C)C)ccc1[N+](=O)[O-] 92675685 JQKYAHUSSYYNLU-UHFFFAOYSA-N 240.328 2.557 5 40 BFBB Cc1n[nH]c2c1nnc1c3ccccc3ccc12 408859 SJFPWKLCYPPTQM-UHFFFAOYSA-N 234.262 2.968 5 40 BFBB CCOC(=O)c1cccc2c([N+](=O)[O-])cccc12 1726624 QPADTPIHSPAZLQ-UHFFFAOYSA-N 245.234 2.925 5 40 BFBB CCCC[N+]1(C)C[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C1 4792421 VQUSOYOKYIOOFB-RRIFHVCJSA-N 206.353 2.685 5 40 BFBB Cc1ccc(NCC(C)C)c([N+](=O)[O-])c1 37401028 KEOPOSKPIZJILG-UHFFFAOYSA-N 208.261 2.971 5 40 BFBB O=[N+]([O-])c1c(Cl)nc(Cl)nc1C(F)F 217638884 BQEQOIIUYLAYAM-UHFFFAOYSA-N 243.984 2.629 5 40 BFBB Cc1c(NC(=O)C2CCC2)cccc1[N+](=O)[O-] 8267648 OQFLARAQFQJDTD-UHFFFAOYSA-N 234.255 2.642 5 40 BFBB Cc1ccc2[nH]c3c(N)cccc3c(=O)c2c1 6733657 KWQLKOXCUHPUBG-UHFFFAOYSA-N 224.263 2.572 5 40 BFBB CC1(C)C=Cc2cc([N+](=O)[O-])ccc2O1 38672974 MJVCBDKNZRGZDF-UHFFFAOYSA-N 205.213 2.779 5 40 BFBB in-vitro O=[N+]([O-])[C@H]1[C@H]2C=C[C@H](C2)[C@@H]1c1ccccc1 1734756 ABLIRAIUNBLRPK-VOAKCMCISA-N 215.252 2.621 5 40 BFBB CC(C)OC(=O)c1cc([N+](=O)[O-])ccc1Cl 57464829 CEUQXFVBCCZXLX-UHFFFAOYSA-N 243.646 2.813 5 40 BFBB O=[N+]([O-])c1ccc([C@H]2C[C@]2(F)Cl)cc1 4671689 RBYIEBIWCJVVCR-RKDXNWHRSA-N 215.611 2.987 5 40 BFBB COc1cc2c(cc1/C=C(\C)[N+](=O)[O-])O[C@@H](C)C2 4160039 DBZWDPBKQWJZKV-SGDMMICCSA-N 249.266 2.656 5 40 BFBB CC(C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 5384024 GVAXQKBMOYAIRT-UHFFFAOYSA-N 242.662 2.843 5 40 BFBB O=[N+]([O-])c1ccc(CNCc2cccs2)cc1 16430651 ZLUOHGFUSMSYAG-UHFFFAOYSA-N 248.307 2.946 5 40 BFBB O=[N+]([O-])c1ccc(Sc2ncc[nH]2)c(F)c1 76063777 FCMJDCCJXBZNQQ-UHFFFAOYSA-N 239.231 2.608 5 40 BFBB [O-][n+]1c2ccccc2nc2cccc(Cl)c21 76495198 QVHGABNOEIQDND-UHFFFAOYSA-N 230.654 2.675 5 40 BFBB CC(C)(C)Nc1nc2cc([N+](=O)[O-])ccc2o1 548542 UCMGCKLIMYTYGE-UHFFFAOYSA-N 235.243 2.946 5 40 BFBB Cc1c(Cl)cnc(Cl)c1[N+](=O)[O-] 8698157 ZFKZTPHCAGROAN-UHFFFAOYSA-N 207.016 2.605 5 40 BFBB CC[N+]1(CC)CC2=C(Cl)C=CC[C@@H]2C1 346424 OTVVECHGCQHNPK-SNVBAGLBSA-N 212.744 2.926 5 40 BFBB Cc1cc(F)c2ncccc2c1[N+](=O)[O-] 85399702 JQZCHHCKRHYYKX-UHFFFAOYSA-N 206.176 2.591 5 40 BFBB O=[N+]([O-])[C@@H]1CC=CC[C@H]1c1ccccc1 1561809 UXWVJBRZRRCUHU-NWDGAFQWSA-N 203.241 2.766 5 40 BFBB CC[C@@H](CCC(=O)c1ccccc1)[N+](=O)[O-] 1595453 QHVUOXLSHJNRFB-NSHDSACASA-N 221.256 2.705 5 40 BFBB CC/C(=C\c1ccc(OC)cc1)[N+](=O)[O-] 8581137 RAKQDPNZDWUGOD-CSKARUKUSA-N 207.229 2.723 5 40 BFBB O=[N+]([O-])[C@@H]1CC[C@@H]2CC[C@H]3CCC[C@@H]1[C@@H]23 5328129 WUTRGTKNJPEJDE-YBXAARCKSA-N 209.289 2.868 5 40 BFBB CCC[C@@H](C)Oc1cccnc1[N+](=O)[O-] 79001402 QVSORUUINXBSOR-MRVPVSSYSA-N 210.233 2.557 5 40 BFBB Cn1c(=O)n(C)c2ccc3ccc4ccc1c2c43 353563 FMSQVMMNJBNNML-UHFFFAOYSA-N 236.274 2.621 5 40 BFBB O=Cc1ccc(Oc2ccccc2[N+](=O)[O-])o1 72228409 IUYUIPSQFRIURY-UHFFFAOYSA-N 233.179 2.793 5 40 BFBB O=[N+]([O-])c1cc2nc(Cl)oc2cc1F 258329878 BPZJTUUHZPLYAN-UHFFFAOYSA-N 216.555 2.529 5 40 BFBB C[C@@H](Cc1ccco1)Nc1ccc([N+](=O)[O-])cn1 25575657 JIMQUQJGZQQMDF-VIFPVBQESA-N 247.254 2.626 5 40 BFBB CCCOc1c(C)cc([N+](=O)[O-])cc1C=O 225272563 LXVHXGPNSXHELB-UHFFFAOYSA-N 223.228 2.505 5 40 BFBB COC[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 96034464 VBNFAZYMYFVMFE-ZETCQYMHSA-N 245.662 2.662 5 40 BFBB Cc1noc(/C=C/c2ccccc2O)c1[N+](=O)[O-] 1582942 TXOHTEBDEXXXME-VOTSOKGWSA-N 246.222 2.767 5 40 BFBB O=c1c2ccccc2oc2ccc(O)cc12 3979037 WSACHQJPCNOREV-UHFFFAOYSA-N 212.204 2.652 5 40 BFBB endogenous,in-man CCCCC[C@H](C)n1cc([N+](=O)[O-])cn1 67800408 HKENSBZQLNFAIK-VIFPVBQESA-N 211.265 2.933 5 40 BFBB CC(=O)c1cc([N+](=O)[O-])c(Cl)s1 2150003 HHHNIUPEIAJYKY-UHFFFAOYSA-N 205.622 2.512 5 40 BFBB in-vitro Cc1nc2cc3nc4ccccc4nc3cc2[nH]1 4159274 ZPQQNNBHJZZHES-UHFFFAOYSA-N 234.262 2.968 5 40 BFBB CC/C(=C/c1ccc(OC)cc1)[N+](=O)[O-] 1592091 RAKQDPNZDWUGOD-NTMALXAHSA-N 207.229 2.723 5 40 BFBB O=[N+]([O-])c1ccc(-c2nc3ccc(F)cc3[nH]2)o1 8652521 YKCVVHOLBKXNPV-UHFFFAOYSA-N 247.185 2.870 5 40 BFBB Cc1ccc([N+](=O)[O-])c(NCC(C)C)c1 87150660 DDZSFHKQKIAFII-UHFFFAOYSA-N 208.261 2.971 5 40 BFBB Nc1ccc(C2CCCC2)cc1[N+](=O)[O-] 165139546 ZZHKBUFTUQSDPX-UHFFFAOYSA-N 206.245 2.835 5 40 BFBB O=[N+]([O-])c1cccc2ncc(Cl)cc12 9355835 JYTNRQXYPGHCMY-UHFFFAOYSA-N 208.604 2.796 5 40 BFBB Cc1noc(/C=C\c2cccc(O)c2)c1[N+](=O)[O-] 408541462 CSTJTURHPVBZKU-WAYWQWQTSA-N 246.222 2.767 5 40 BFBB N#Cn1c2ccccc2c(=N)c2ccccc21 5594065 XDWWYSFVTWDWSW-UHFFFAOYSA-N 219.247 2.603 5 40 BFBB CN(Cc1cccs1)c1ncccc1[N+](=O)[O-] 23653103 CHLWOZKSNUXUHH-UHFFFAOYSA-N 249.295 2.688 5 40 BFBB Cc1cn2c(nc3ccc([N+](=O)[O-])cc32)s1 12932742 KQVJMWYPJOLBRI-UHFFFAOYSA-N 233.252 2.766 5 40 BFBB O=[N+]([O-])c1ccccc1OCCC(F)(F)F 263758995 KQQOOHUIKYWMDF-UHFFFAOYSA-N 235.161 2.926 5 40 BFBB CCCCC(=O)Nc1ccccc1[N+](=O)[O-] 4666136 KIDROIRZVOUZJO-UHFFFAOYSA-N 222.244 2.724 5 40 BFBB CCc1c([N+](=O)[O-])c2cc([N+](=O)[O-])ccc2n1C 4963152 GIBAWVVBJMJZNQ-UHFFFAOYSA-N 249.226 2.557 5 40 BFBB CC[N+](C)(CC)CC[N+]1(C)Cc2ccccc2C1 1673465 CDWXMMYPVRFXKR-UHFFFAOYSA-N 248.414 2.633 5 40 BFBB CCCOc1ccc([N+](=O)[O-])c2cccnc12 225394120 WKGBKKUZTXGLHV-UHFFFAOYSA-N 232.239 2.932 5 40 BFBB O=C1CCc2c1cc([N+](=O)[O-])c1c2CCCC1 2113469519 AYEAVPJCJMZQOR-UHFFFAOYSA-N 231.251 2.603 5 40 BFBB C[C@H]1CC(C)(C)O[C@H](C[N+]2(C)CCCCC2)O1 546543 VUXRJJNWKQSEAV-QWHCGFSZSA-N 242.383 2.547 5 40 BFBB O=[N+]([O-])c1c(Cl)ccc(Cl)c1[N+](=O)[O-] 4256051 WZUODOWOJWDKTK-UHFFFAOYSA-N 236.998 2.810 5 40 BFBB CC(C)COc1n[nH]c2ccc([N+](=O)[O-])cc12 72226532 RDFMWEMMTMAGGH-UHFFFAOYSA-N 235.243 2.506 5 40 BFBB CCOC(=N)c1ccc(Cl)c([N+](=O)[O-])c1 90460605 FOQKRHUOCGNNRV-UHFFFAOYSA-N 228.635 2.610 5 40 BFBB CCC(=O)N[C@H](CC)c1cccc([N+](=O)[O-])c1 96454693 YAMZPKGHHARRJF-LLVKDONJSA-N 236.271 2.572 5 40 BFBB CCCOc1ccc(/C=C/[N+](=O)[O-])cc1 1687852 VKWWKOVGOMKAOT-BQYQJAHWSA-N 207.229 2.723 5 40 BFBB CCN(C)[C@H](C)c1ccccc1[N+](=O)[O-] 75682463 RUZMEBMKBKBBKH-SECBINFHSA-N 208.261 2.608 5 40 BFBB Cc1occc1CN(C)c1ccc([N+](=O)[O-])cn1 48921692 RQVSMDXBCOFJBA-UHFFFAOYSA-N 247.254 2.528 5 40 BFBB O=[N+]([O-])c1ccc2c(c1)[C@H](O)c1ccccc1-2 900552 ZUXWEWNCAHRWBV-CYBMUJFWSA-N 227.219 2.657 5 40 BFBB in-vitro Cc1cc([N+](=O)[O-])c2ccccc2c1N 4522413 GMLQIHVBNPJKHR-UHFFFAOYSA-N 202.213 2.639 5 40 BFBB CCn1c(Cl)nc2cc([N+](=O)[O-])ccc21 256049812 BNJRKIFYZXEERT-UHFFFAOYSA-N 225.635 2.618 5 40 BFBB Cc1c(/C=C/[N+](=O)[O-])c2ccccc2n1C 562978 XASGEICHPWXWJC-BQYQJAHWSA-N 216.240 2.734 5 40 BFBB Nc1cc(Sc2ccccn2)cc([N+](=O)[O-])c1 2573078 PTXMBGKCLMMSEP-UHFFFAOYSA-N 247.279 2.723 5 40 BFBB O=Cc1ccc(-c2ccc(F)c([N+](=O)[O-])c2)o1 1406794 XGNGASNRZFGUNX-UHFFFAOYSA-N 235.170 2.806 5 40 BFBB CC(=O)c1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 258837445 RTGXFRGNLYYZGG-UHFFFAOYSA-N 249.144 2.696 5 40 BFBB CC(=O)Nc1ccc2c(ccc3cccc[n+]32)c1 1697985 HYAOTZYYJRNDID-UHFFFAOYSA-O 237.282 2.537 5 40 BFBB O=[N+]([O-])c1ccc(-c2nsc(Cl)n2)cc1 47218923 GULLVHSUPXBMAI-UHFFFAOYSA-N 241.659 2.767 5 40 BFBB Cc1c(C)n(C)c2ccc([N+](=O)[O-])cc12 553012 SPGFLBYNOCFQGL-UHFFFAOYSA-N 204.229 2.703 5 40 BFBB Nc1nc(N)c2c(ccc3ccc(Cl)cc32)n1 1722909 YLALQNZRNZTGHV-UHFFFAOYSA-N 244.685 2.601 5 40 BFBB COc1cccc2ccc([N+](=O)[O-])cc12 71256675 OXHHXEHJNCWQBP-UHFFFAOYSA-N 203.197 2.757 5 40 BFBB Nc1c(Cl)cc(Cl)c(F)c1[N+](=O)[O-] 113304564 VMKPPMDOILEYED-UHFFFAOYSA-N 225.006 2.623 5 40 BFBB CCSCCOc1c(F)cccc1[N+](=O)[O-] 185017149 CWWOKKFHUHTKSJ-UHFFFAOYSA-N 245.275 2.866 5 40 BFBB C/C=C/C=C\C(=O)Nc1ccc([N+](=O)[O-])cc1 8612505 FAWZPFLKIAIQCM-IAROGAJJSA-N 232.239 2.666 5 40 BFBB Cc1cccc(Sc2c([N+](=O)[O-])ncn2C)c1 480499 DCEBBNPGMFEIRF-UHFFFAOYSA-N 249.295 2.788 5 40 BFBB CC(C)Sc1nc2sccn2c1[N+](=O)[O-] 1395909 GPBXXVMKTQYXLM-UHFFFAOYSA-N 243.313 2.805 5 40 BFBB Cc1ccc(OCC(F)F)c([N+](=O)[O-])c1 20348944 JHIKTDRZHQHPQG-UHFFFAOYSA-N 217.171 2.547 5 40 BFBB C[C@H](Nc1ncccn1)c1cccc([N+](=O)[O-])c1 76846277 FWPUVTJKZYXGEV-VIFPVBQESA-N 244.254 2.558 5 40 BFBB CCc1ccc(NC(=O)C(C)C)cc1[N+](=O)[O-] 27318354 IIQJSXGLPDTOLZ-UHFFFAOYSA-N 236.271 2.752 5 40 BFBB COc1cccc2[nH]c3ccccc3c(=O)c12 4430221 NSKBTSFWBPFPMI-UHFFFAOYSA-N 225.247 2.690 5 40 BFBB C/C=C(/C)COC(=O)c1ccc([N+](=O)[O-])cc1 1700505 AIEQXEYCNMNHNS-OQFOIZHKSA-N 235.239 2.718 5 40 BFBB CC(C)(C)C(=O)COc1ccc([N+](=O)[O-])cc1 24834352 WUFLQKWWWUBFJK-UHFFFAOYSA-N 237.255 2.589 5 40 BFBB C[N+]1(Cc2ccccc2)C[C@H]2CC(=O)C[C@@H](C2)C1 100490016 OLHVHZNBHXEFMT-HUUCEWRRSA-N 244.358 2.632 5 40 BFBB O=[N+]([O-])Cc1cccc(Cl)c1Cl 113525149 MWWBWKCNBCFWIC-UHFFFAOYSA-N 206.028 2.770 5 40 BFBB C[N+]1(C[Si](C)(C)c2ccccc2)CCCCC1 195793365 VNJXDBFEBDQEQH-UHFFFAOYSA-N 248.466 2.772 5 40 BFBB Cc1cc([N+](=O)[O-])c(N)cc1N1CCCC[C@@H]1C 216863299 KFYAQQWBLHTHHQ-JTQLQIEISA-N 249.314 2.864 5 40 BFBB C[n+]1ccccc1/C=C\c1ccc([N+](=O)[O-])cc1 17157650 ACBYPCKIUCQSGR-YVMONPNESA-N 241.270 2.590 5 40 BFBB O=C(O)/C=C/c1ccc2ccccc2c1[N+](=O)[O-] 44201268 UPWPYTZWXWYVHL-BQYQJAHWSA-N 243.218 2.846 5 40 BFBB CC[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1C 372627 HTZCMMBSPIBFHX-MRVPVSSYSA-N 236.271 2.888 5 40 BFBB O=[N+]([O-])[C@@H]1[C@H](c2ccccc2)[C@@H]2C=C[C@H]1C2 5104783 ABLIRAIUNBLRPK-XQHKEYJVSA-N 215.252 2.621 5 40 BFBB O=[N+]([O-])c1cc(F)ccc1OCc1ccco1 36617327 SIHMNDMAQGUAEU-UHFFFAOYSA-N 237.186 2.906 5 40 BFBB CCCNc1ccc(C(C)=O)cc1[N+](=O)[O-] 82538899 KYQNOJRIKYBQSB-UHFFFAOYSA-N 222.244 2.619 5 40 BFBB O=C(c1ccc(O)cc1)c1ccccc1[N+](=O)[O-] 71245591 VVSIPWIQRLVVEF-UHFFFAOYSA-N 243.218 2.531 5 40 BFBB O=[N+]([O-])c1ccccc1-c1cn2ccccc2n1 113333752 DTBSXWZAGZBRTA-UHFFFAOYSA-N 239.234 2.910 5 40 BFBB Cc1ccc(-n2cccc2)cc1[N+](=O)[O-] 455068 DODNRNONGJJAQL-UHFFFAOYSA-N 202.213 2.694 5 40 BFBB CSc1ccc(Cl)cc1[N+](=O)[O-] 39294669 FVYWHGBTHWHFQV-UHFFFAOYSA-N 203.650 2.970 5 40 BFBB O=[N+]([O-])[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1c1ccccc1 100170128 XLJNFVWRSYMVKN-CYDGBPFRSA-N 217.268 2.845 5 40 BFBB CN(C)C(=S)Sc1ccc([N+](=O)[O-])cc1 1716475 BSPPFEBCCBLHGW-UHFFFAOYSA-N 242.325 2.533 5 40 BFBB O=[N+]([O-])c1cc(CSc2ncc[nH]2)cs1 96430211 DMKURKXDGLZXHR-UHFFFAOYSA-N 241.297 2.672 5 40 BFBB Cc1c(O)c2ccc3ccccc3c2oc1=O 103969950 BDCDJTWOSVPTQQ-UHFFFAOYSA-N 226.231 2.960 5 40 BFBB CN(C(=O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 20495889 DSMZMXNEYYJUPF-UHFFFAOYSA-N 248.282 2.609 5 40 BFBB OCn1c2ccccc2c2nc3ccccc3nc21 28294435 FBJQEGBKPUNZMF-UHFFFAOYSA-N 249.273 2.688 5 40 BFBB Cc1ncc([N+](=O)[O-])n1CCCc1ccccc1 71914308 CHRUGXBBPKAXJQ-UHFFFAOYSA-N 245.282 2.733 5 40 BFBB Cc1ccc(-c2ccc(CO)o2)cc1[N+](=O)[O-] 533126 ZZZNTWBOCMQFGP-UHFFFAOYSA-N 233.223 2.656 5 40 BFBB COCc1cccc([N+](=O)[O-])c1Br 39077423 MOGAKUBWUBOCQF-UHFFFAOYSA-N 246.060 2.504 5 40 BFBB CC(C)COc1cccc(F)c1[N+](=O)[O-] 54268910 WUXBZEULPAYSFD-UHFFFAOYSA-N 213.208 2.769 5 40 BFBB Cc1cccc(C(=O)c2ccc([N+](=O)[O-])cc2)n1 45028486 ZHKQNOKMMVJBOH-UHFFFAOYSA-N 242.234 2.529 5 40 BFBB CC(=O)c1c(O)ccc2nc3ccccc3nc12 104199270 ODSWIWGMAMALEG-UHFFFAOYSA-N 238.246 2.691 5 40 BFBB Cc1ccc(Nc2n[nH]c(C)c2[N+](=O)[O-])cc1 5012640 MYKCDAZEXCEWHK-UHFFFAOYSA-N 232.243 2.678 5 40 BFBB O=[N+]([O-])c1ccc(/C=C/c2csnn2)cc1 5722005 STAYCBUZFVGGLZ-DAFODLJHSA-N 233.252 2.617 5 40 BFBB CC[n+]1c2ccccc2nc2cc(OC)ccc21 95869968 FZIUBVZPGHRPRF-UHFFFAOYSA-N 239.298 2.704 5 40 BFBB CC(C)n1c(S)nc2cc([N+](=O)[O-])ccc21 256052685 OHJXFBNPYQCCRZ-UHFFFAOYSA-N 237.284 2.814 5 40 BFBB N[C@H](CO)c1ccc2cc3ccccc3cc2c1 72198836 IYXAWKPHWZYHDL-MRXNPFEDSA-N 237.302 2.985 5 40 BFBB CCCCNc1ncnc2ccc([N+](=O)[O-])cc12 80109162 XHVJMTUZSLKXNV-UHFFFAOYSA-N 246.270 2.750 5 40 BFBB CC(=O)Nc1c([N+](=O)[O-])cccc1C(C)(C)C 4127974 YTEJEHJQNAQKKV-UHFFFAOYSA-N 236.271 2.851 5 40 BFBB O=[N+]([O-])c1ccc(-c2cnc3n2CCCC3)cc1 26506726 PACKBIACLRYCSL-UHFFFAOYSA-N 243.266 2.795 5 40 BFBB CC(C)(C)c1noc(-c2ccc([N+](=O)[O-])cc2)n1 32911310 DRNAXTOXRXRQKP-UHFFFAOYSA-N 247.254 2.942 5 40 BFBB in-vitro O=C(O)c1ccc2c3c(ccc([N+](=O)[O-])c13)CC2 1740816390 BXYDOOAAYVPMRU-UHFFFAOYSA-N 243.218 2.545 5 40 BFBB N=c1c2ccccc2nc2oc3ccccc3n12 5594071 SUKJLFABTFOQDA-UHFFFAOYSA-N 235.246 2.713 5 40 BFBB Cc1ccc(C(=O)C(F)(F)F)cc1[N+](=O)[O-] 107734166 PMTPWJJILUIJEI-UHFFFAOYSA-N 233.145 2.648 5 40 BFBB CSc1nc2ccc([N+](=O)[O-])cc2s1 161309 UGURRSVQWLYDOY-UHFFFAOYSA-N 226.282 2.926 5 40 BFBB O=[N+]([O-])c1c(F)cccc1OC(F)(F)F 95215664 RBZBREVEJXOMPX-UHFFFAOYSA-N 225.097 2.633 5 40 BFBB CCC[C@H](C)OC(=O)c1cccc([N+](=O)[O-])c1 2045153 LPXMRDZFWZZBEY-VIFPVBQESA-N 237.255 2.940 5 40 BFBB biogenic C[N+]1(Cc2ccc3c(c2)OCO3)CCCCC1 1775368 QWUPLKJEDSIVCH-UHFFFAOYSA-N 234.319 2.546 5 40 BFBB O=[N+]([O-])c1ccc2cccc([N+](=O)[O-])c2c1 6094559 ZAIDGMWHINKYFA-UHFFFAOYSA-N 218.168 2.656 5 40 BFBB in-vitro O=[N+]([O-])c1ccccc1-c1ccccc1CO 1556568 WXDSSNPFKIESQN-UHFFFAOYSA-N 229.235 2.754 5 40 BFBB C[C@H]1CCCCN1C(=O)c1cccc([N+](=O)[O-])c1 5533485 JRESSPPYACPTSL-JTQLQIEISA-N 248.282 2.609 5 40 BFBB CC(C)Oc1ccc(/C=C/[N+](=O)[O-])cc1 1687853 MKAVWDRRDKUNDX-BQYQJAHWSA-N 207.229 2.721 5 40 BFBB Cc1c(/C=C\[N+](=O)[O-])c2ccccc2n1C 5007673 XASGEICHPWXWJC-FPLPWBNLSA-N 216.240 2.734 5 40 BFBB CC(C)c1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 40175780 UKJDHFZKTZJPKR-UHFFFAOYSA-N 232.243 2.503 5 40 BFBB CC1(C)CCN1Cc1ccc([N+](=O)[O-])cc1F 84673520 PTGWLHVIVCAJSC-UHFFFAOYSA-N 238.262 2.718 5 40 BFBB Nc1c(Cl)cc([N+](=O)[O-])c2ccccc12 98175194 UFSGFZKLHXQXSO-UHFFFAOYSA-N 222.631 2.984 5 40 BFBB O=[N+]([O-])c1cccnc1NCc1ccccc1F 21794272 SWSCXXRDULOLFZ-UHFFFAOYSA-N 247.229 2.741 5 40 BFBB O=C(O)c1c([N+](=O)[O-])ccc(Cl)c1Cl 21985399 MWFKWTVYKGMWEH-UHFFFAOYSA-N 236.010 2.600 5 40 BFBB O=[N+]([O-])C1=Cc2ccccc2O[C@@H]1C(F)(F)F 6658052 BGTJUOYBNMSGRC-VIFPVBQESA-N 245.156 2.628 5 40 BFBB O=[N+]([O-])c1cccc([C@@H](O)c2ccccc2)c1 34850237 MFQIIAVCROYVQC-ZDUSSCGKSA-N 229.235 2.677 5 40 BFBB Cc1cc([N+](=O)[O-])c(N)cc1N1CCC(C)CC1 216863347 FQPPDZUTSQJZGL-UHFFFAOYSA-N 249.314 2.722 5 40 BFBB CC(=O)Nc1cc(C(C)C)c([N+](=O)[O-])cc1C 4705837 BYDMLHYKFQMQJT-UHFFFAOYSA-N 236.271 2.985 5 40 BFBB COC(=O)c1cc2ccc([N+](=O)[O-])cc2s1 35569490 NTWQXMNKLCUVKU-UHFFFAOYSA-N 237.236 2.596 5 40 BFBB NCc1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1 38080312 MTPXIIXVJTWHRL-UHFFFAOYSA-N 244.250 2.846 5 40 BFBB in-vitro C[N+]1([C@H]2CC[C@H]3CCC[C@@H]2C3=O)CCCCC1 1229980 RDMYHQLYZMGUBF-RDBSUJKOSA-N 236.379 2.765 5 40 BFBB CC(C)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 37430096 MTWKJSPSNCQZPH-GQCTYLIASA-N 235.239 2.816 5 40 BFBB CC(=O)CCc1c[nH]c2cccc([N+](=O)[O-])c12 2541458 DODINSMBTAQWQA-UHFFFAOYSA-N 232.239 2.598 5 40 BFBB CCC(CC)NC(=O)c1ccc([N+](=O)[O-])s1 9914038 JVUCAGQLPPIPGA-UHFFFAOYSA-N 242.300 2.575 5 40 BFBB CN(Cc1ccccc1)c1ccc([N+](=O)[O-])cn1 19645541 UDCCELHBERLWLW-UHFFFAOYSA-N 243.266 2.626 5 40 BFBB O=[N+]([O-])c1cc2c(cc1Cl)OC(F)(F)O2 31829497 QEWABJKDRJAJMP-UHFFFAOYSA-N 237.545 2.570 5 40 BFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCCC1 16973661 JGABGVPWMMIACH-UHFFFAOYSA-N 249.270 2.531 5 40 BFBB Cc1cccc2nc3cccc(O)c3nc12 32237977 XXUGUVGBZCZVDQ-UHFFFAOYSA-N 210.236 2.797 5 40 BFBB O=C1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] 36405302 WHRFCXKVKLNWAI-SNVBAGLBSA-N 219.240 2.507 5 40 BFBB in-vitro CCc1ccc(C(=O)c2ccc([N+](=O)[O-])cc2)o1 72314784 WFCNROCXLJMRGP-UHFFFAOYSA-N 245.234 2.981 5 40 BFBB in-vitro O=[N+]([O-])c1ccc(F)cc1OCC(F)(F)F 83021746 USOVRXNIZFSGEU-UHFFFAOYSA-N 239.124 2.675 5 40 BFBB CC[N+](C)(CC)C/C=C/CC[N+](C)(CC)CC 6424754 CNOZHSRXPBNGPV-VAWYXSNFSA-N 242.451 2.906 5 40 BFBB COC(=O)c1cccc2nc3ccccc3nc12 14651182 UEHCMQFOWIRZGQ-UHFFFAOYSA-N 238.246 2.570 5 40 BFBB biogenic,in-vitro C[C@@H](Cn1ccc([N+](=O)[O-])n1)c1ccccc1 71978610 FSNNCOFVHBBNNF-JTQLQIEISA-N 231.255 2.595 5 40 BFBB Cc1ccc(Oc2nn(C)cc2[N+](=O)[O-])c(C)c1 95098482 FWMMQGNYBKLSCC-UHFFFAOYSA-N 247.254 2.737 5 40 BFBB COc1cc(C(F)F)c([N+](=O)[O-])cc1OC 575671081 HAEUCEMTOBRDRK-UHFFFAOYSA-N 233.170 2.550 5 40 BFBB