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

*Links on SpectraBase are not permalinks.
Isoniazid AC
SpectraBase Compound ID CGNn3mXjbyK
InChI InChI=1S/C8H9N3O2/c1-6(12)10-11-8(13)7-2-4-9-5-3-7/h2-5H,1H3,(H,10,12)(H,11,13)
InChIKey CVBGNAKQQUWBQV-UHFFFAOYSA-N
Mol Weight 179.18 g/mol
Molecular Formula C8H9N3O2
Exact Mass 179.069477 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 8Jxfp3TQdQu
Name Isoniazid AC
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 179.069476540 u
Formula C8H9N3O2
InChI InChI=1S/C8H9N3O2/c1-6(12)10-11-8(13)7-2-4-9-5-3-7/h2-5H,1H3,(H,10,12)(H,11,13)
InChIKey CVBGNAKQQUWBQV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 179.179 g/mol
Nominal Mass 179 u
Quality 993
Retention Index 1569
SMILES C(NNC(=O)C)(C1=CC=NC=C1)=O
SPLASH splash10-056u-7900000000-efcbc636613855252393
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N'-(pyridin-4-ylcarbonyl)ethanehydrazide
Technique GC/MS
Wiley ID DD2024_001777