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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 FF65NOipZnV
Name Isonicotinamide
Carrier Gas Helium (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 122.048012820 u
Formula C6H6N2O
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9)
InChIKey VFQXVTODMYMSMJ-UHFFFAOYSA-N
Inlet Type Split (100:1)
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1016/j.rechem.2022.100760
Molecular Weight 122.127 g/mol
Quality 159
SMILES NC(C1=CC=NC=C1)=O
SPLASH splash10-00fr-2900000000-575211ed3586862883a9
Source of Spectrum REC-5-SM4-9b (DOI: 10.1016/j.rechem.2022.100760)
Wiley ID 1911855