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Isoniazid PFP
SpectraBase Compound ID KaFxN4y2Cp8
InChI InChI=1S/C9H6F5N3O2/c10-8(11,9(12,13)14)7(19)17-16-6(18)5-1-3-15-4-2-5/h1-4H,(H,16,18)(H,17,19)
InChIKey ZKNQYHBECRKLHW-UHFFFAOYSA-N
Mol Weight 283.16 g/mol
Molecular Formula C9H6F5N3O2
Exact Mass 283.038017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH56hM4QVKy
Name Isoniazid PFP
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 283.038017258 u
Formula C9H6F5N3O2
InChI InChI=1S/C9H6F5N3O2/c10-8(11,9(12,13)14)7(19)17-16-6(18)5-1-3-15-4-2-5/h1-4H,(H,16,18)(H,17,19)
InChIKey ZKNQYHBECRKLHW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 283.158 g/mol
Nominal Mass 283 u
Quality 994
Retention Index 2257
SMILES C(C(NNC(C1=CC=NC=C1)=O)=O)(C(F)(F)F)(F)F
SPLASH splash10-0a4i-8900000000-45997a462362c661dbf6
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2,2,3,3,3-pentafluoro-N'-(pyridin-4-ylcarbonyl)propanehydrazide
Technique GC/MS
Wiley ID DD2024_001778