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2-(4-Methylphenyl)-3H-1,3-benzodiazepine-4-carboxylic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

2-(4-Methylphenyl)-3H-1,3-benzodiazepine-4-carboxylic acid ethyl ester
SpectraBase Compound ID 8OfhiA6UKxn
InChI InChI=1S/C19H18N2O2/c1-3-23-19(22)17-12-15-6-4-5-7-16(15)20-18(21-17)14-10-8-13(2)9-11-14/h4-12H,3H2,1-2H3,(H,20,21)
InChIKey KVADPOCROJLIPM-UHFFFAOYSA-N
Mol Weight 306.36 g/mol
Molecular Formula C19H18N2O2
Exact Mass 306.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JX1P5UYKYEV
Name 2-(4-Methylphenyl)-3H-1,3-benzodiazepine-4-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N2O2
InChI InChI=1S/C19H18N2O2/c1-3-23-19(22)17-12-15-6-4-5-7-16(15)20-18(21-17)14-10-8-13(2)9-11-14/h4-12H,3H2,1-2H3,(H,20,21)
InChIKey KVADPOCROJLIPM-UHFFFAOYSA-N
Molecular Weight 306.365 g/mol
SMILES N1C(=Cc2c(N=C1c1ccc(cc1)C)cccc2)C(=O)OCC
SPLASH splash10-0a59-5596000000-f4a50812147091125115
Source of Spectrum F-48-3107-19
Synonyms 2-(p-tolyl)-3H-1,3-benzodiazepine-4-carboxylic acid ethyl ester Ethyl 2-(4-methylphenyl)-3H-1,3-benzodiazepine-4-carboxylate Ethyl 2-(p-tolyl)-3H-1,3-benzodiazepine-4-carboxylate
Wiley ID 1308336