For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Chlordiazepoxide
SpectraBase Compound ID C0wF2v7ck9J
InChI InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19)
InChIKey ANTSCNMPPGJYLG-UHFFFAOYSA-N
Mol Weight 299.76 g/mol
Molecular Formula C16H14ClN3O
Exact Mass 299.08254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2Sd274bNV37
Name Chlordiazepoxide
Catalog Number 14261
Lot Number 625260
CAS Registry Number 58-25-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.082539782 u
Formula C16H14ClN3O
InChI InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19)
InChIKey ANTSCNMPPGJYLG-UHFFFAOYSA-N
Purity >=98%
Quality 986
SMILES N(C1=NC2=CC=C(C=C2C(=[N+]([O-])C1)C1=CC=CC=C1)Cl)C
SPLASH splash10-001i-2590000000-954c10cdfb19fae9eae9
Source of Spectrum CAY-2024-2250-0
Synonyms Methaminodiazepoxide 7-chloro-2-(methylamino)-5-phenyl-3H-benzo[e][1,4]diazepine 4-oxide 7-chloro-2-(methylamino)-5-phenyl-3H-1,4-benzodiazepin-4-ium-4-olate
Wiley ID 1890435