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5,6-Dimethyl-4-phenyl-3-cyanopyridine-2(1H)-thione
SpectraBase Compound ID A9oDNyXXiaf
InChI InChI=1S/C14H12N2S/c1-9-10(2)16-14(17)12(8-15)13(9)11-6-4-3-5-7-11/h3-7H,1-2H3,(H,16,17)
InChIKey RLFKKQHKSXJLLP-UHFFFAOYSA-N
Mol Weight 240.32 g/mol
Molecular Formula C14H12N2S
Exact Mass 240.07212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xUV3bd1lY
Name 5,6-Dimethyl-4-phenyl-3-cyanopyridine-2(1H)-thione
CAS Registry Number 94639-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N2S
InChI InChI=1S/C14H12N2S/c1-9-10(2)16-14(17)12(8-15)13(9)11-6-4-3-5-7-11/h3-7H,1-2H3,(H,16,17)
InChIKey RLFKKQHKSXJLLP-UHFFFAOYSA-N
Molecular Weight 240.324 g/mol
SMILES N1C(=C(C(=C(C1=S)C#N)c1ccccc1)C)C
SPLASH splash10-000f-0190000000-866c0793568ad1257995
Source of Spectrum F9-1986-157-0
Synonyms 5,6-Dimethyl-4-phenyl-2-sulfanylidene-1H-pyridine-3-carbonitrile 5,6-Dimethyl-4-phenyl-2-thioxo-1,2-dihydro-3-pyridinecarbonitrile 5,6-Dimethyl-4-phenyl-2-thioxo-1H-pyridine-3-carbonitrile
Wiley ID 1565687