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2-Propenenitrile, 3-(1-cyclohexyl-1,2-dihydro-2-thioxo-3-pyridinyl)-, (E)-
SpectraBase Compound ID 4by3IJGSfak
InChI InChI=1S/C14H16N2S/c15-10-4-6-12-7-5-11-16(14(12)17)13-8-2-1-3-9-13/h4-7,11,13H,1-3,8-9H2/b6-4+
InChIKey RLOVTVSZXUSYFU-GQCTYLIASA-N
Mol Weight 244.36 g/mol
Molecular Formula C14H16N2S
Exact Mass 244.10342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnWojwaEaqL
Name 2-Propenenitrile, 3-(1-cyclohexyl-1,2-dihydro-2-thioxo-3-pyridinyl)-, (E)-
CAS Registry Number 89818-17-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2S
InChI InChI=1S/C14H16N2S/c15-10-4-6-12-7-5-11-16(14(12)17)13-8-2-1-3-9-13/h4-7,11,13H,1-3,8-9H2/b6-4+
InChIKey RLOVTVSZXUSYFU-GQCTYLIASA-N
Molecular Weight 244.356 g/mol
SMILES C1(N(C=CC=C1\C=C\C#N)C1CCCCC1)=S
SPLASH splash10-03di-0920000000-007e731cc2ce4cb3d46b
Source of Spectrum Y-20-1655-0
Synonyms (E)-3-(1-cyclohexyl-2-sulfanylidene-3-pyridinyl)-2-propenenitrile (E)-3-(1-cyclohexyl-2-sulfanylidene-pyridin-3-yl)prop-2-enenitrile (E)-3-(1-cyclohexyl-2-thioxo-3-pyridyl)acrylonitrile (E)-3-(1-cyclohexyl-2-thioxo-3-pyridyl)prop-2-enenitrile
Wiley ID 1247187