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2-(Phenylthio)isonicotinonitrile
SpectraBase Compound ID CTA6YM2oHa5
InChI InChI=1S/C12H8N2S/c13-9-10-6-7-14-12(8-10)15-11-4-2-1-3-5-11/h1-8H
InChIKey OECPYYHEWCPLMI-UHFFFAOYSA-N
Mol Weight 212.27 g/mol
Molecular Formula C12H8N2S
Exact Mass 212.040819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhjAfREcAG7
Name 2-(Phenylthio)isonicotinonitrile
Alternate Name(s) 2-(Phenylthio)-4-pyridinecarbonitrile 2-Phenylsulfanylpyridine-4-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8N2S
InChI InChI=1S/C12H8N2S/c13-9-10-6-7-14-12(8-10)15-11-4-2-1-3-5-11/h1-8H
InChIKey OECPYYHEWCPLMI-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4gc00535j
Molecular Weight 212.270 g/mol
SMILES c1c(cc(nc1)Sc1ccccc1)C#N
SPLASH splash10-03di-1090000000-5198d5c5132ea53d9427
Source of Spectrum GCH-16-3444/SMS6-6ak
Wiley ID 1755433