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4-(pyridine-2-carbonyl)benzonitrile
SpectraBase Compound ID AKB38FfPZZE
InChI InChI=1S/C13H8N2O/c14-9-10-4-6-11(7-5-10)13(16)12-3-1-2-8-15-12/h1-8H
InChIKey JWCRAYQKASCIMD-UHFFFAOYSA-N
Mol Weight 208.22 g/mol
Molecular Formula C13H8N2O
Exact Mass 208.063663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YmCS1QCjad
Name 4-(pyridine-2-carbonyl)benzonitrile
Alternate Name(s) 4-Picolinoylbenzonitrile 4-Pyridin-2-ylcarbonylbenzenecarbonitrile 4-[oxo(2-pyridinyl)methyl]benzonitrile
CAS Registry Number 57954-94-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8N2O
InChI InChI=1S/C13H8N2O/c14-9-10-4-6-11(7-5-10)13(16)12-3-1-2-8-15-12/h1-8H
InChIKey JWCRAYQKASCIMD-UHFFFAOYSA-N
Molecular Weight 208.220 g/mol
SMILES C(c1ccc(C#N)cc1)(c1ncccc1)=O
SPLASH splash10-001i-0920000000-f5c2305d2da6739687c5
Source of Spectrum C-97-7475-0
Wiley ID 1207055