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6-(4-Chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester
SpectraBase Compound ID 5Z2VUogxUTm
InChI InChI=1S/C20H15ClN4O4/c1-2-29-20(26)19-17-10-22-18(12-3-5-13(21)6-4-12)15-9-14(25(27)28)7-8-16(15)24(17)11-23-19/h3-9,11H,2,10H2,1H3
InChIKey ZEBFSOATVOLWIQ-UHFFFAOYSA-N
Mol Weight 410.82 g/mol
Molecular Formula C20H15ClN4O4
Exact Mass 410.078183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 242jPclcssI
Name 6-(4-Chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15ClN4O4
InChI InChI=1S/C20H15ClN4O4/c1-2-29-20(26)19-17-10-22-18(12-3-5-13(21)6-4-12)15-9-14(25(27)28)7-8-16(15)24(17)11-23-19/h3-9,11H,2,10H2,1H3
InChIKey ZEBFSOATVOLWIQ-UHFFFAOYSA-N
Molecular Weight 410.817 g/mol
SMILES c12[n](cnc2C(=O)OCC)-c2c(C(=NC1)c1ccc(cc1)Cl)cc(cc2)N(=O)=O
SPLASH splash10-0gw0-2539100000-78e447fff3c5971d8548
Source of Spectrum Y-28-1668-15
Synonyms Ethyl 6-(4-chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
Wiley ID 1373548