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Isonicotinamide
SpectraBase Compound ID Bkgbp72N0qQ
InChI InChI=1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9)
InChIKey VFQXVTODMYMSMJ-UHFFFAOYSA-N
Mol Weight 122.13 g/mol
Molecular Formula C6H6N2O
Exact Mass 122.048013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mbzhpMgFk6
Name Isonicotinamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6N2O
InChI InChI=1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9)
InChIKey VFQXVTODMYMSMJ-UHFFFAOYSA-N
Instrument Name Agilent 6890-5973N
Ionization Type EI
Literature Reference DOI 10.1002/asia.202100776
Molecular Weight 122.127 g/mol
SMILES NC(c1ccncc1)=O
SPLASH splash10-0kor-9800000000-0e888964c762e55a71b4
Source of Spectrum CAJ-16-SM39-39-1
Wiley ID 1866998