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Diazepam

View entire compound with spectra: 57 NMR, 5 FTIR, 1 Raman, and 48 MS (GC)

Diazepam
SpectraBase Compound ID 4Fwr5rkipCB
InChI InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3
InChIKey AAOVKJBEBIDNHE-UHFFFAOYSA-N
Mol Weight 284.75 g/mol
Molecular Formula C16H13ClN2O
Exact Mass 284.071641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WSh6ltFRXT
Name Diazepam
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClN2O
InChI InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3
InChIKey AAOVKJBEBIDNHE-UHFFFAOYSA-N
Molecular Weight 284.746 g/mol
SMILES c12N(C(CN=C(c2cc(Cl)cc1)c1ccccc1)=O)C
SPLASH splash10-0a59-3590000000-15807a332d2c3bc0ec60
Source of Spectrum SWG-33-3878-0
Synonyms Valium 7-Chloro-1,3-dihydro-1-methyl-5-phenyl-1,4-benzodiazepin-2(3H)-one 7-Chloro-1-methyl-5-phenyl-1,3-dihydro-2H-benzo[e][1,4]diazepin-2-one
Wiley ID 1810552