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1H-1,2-Benzodiazepine-4-carboxylic acid, ethyl ester
SpectraBase Compound ID 89igvD34lQL
InChI InChI=1S/C12H12N2O2/c1-2-16-12(15)10-7-9-5-3-4-6-11(9)14-13-8-10/h3-8,14H,2H2,1H3
InChIKey FYBTUFXUKUIRIT-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C12H12N2O2
Exact Mass 216.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Dx8xAII7X3
Name 1H-1,2-Benzodiazepine-4-carboxylic acid, ethyl ester
CAS Registry Number 85929-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O2
InChI InChI=1S/C12H12N2O2/c1-2-16-12(15)10-7-9-5-3-4-6-11(9)14-13-8-10/h3-8,14H,2H2,1H3
InChIKey FYBTUFXUKUIRIT-UHFFFAOYSA-N
Molecular Weight 216.240 g/mol
SMILES N1c2c(C=C(C=N1)C(=O)OCC)cccc2
SPLASH splash10-00kf-0940000000-47d0ed19e6564461c81b
Source of Spectrum AJ-60-2107-16
Synonyms 4-Ethoxycarbonylbenzo[f]1,2-diazacyclohepta-2,4,diene Ethyl 1H-1,2-benzodiazepine-4-carboxylate
Wiley ID 1215536