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6-[2,2-bis(methylsulfanyl)ethenyl]-2-methyl-4-phenyl-pyridine-3-carbonitrile
SpectraBase Compound ID BkCM32DUZKR
InChI InChI=1S/C17H16N2S2/c1-12-16(11-18)15(13-7-5-4-6-8-13)9-14(19-12)10-17(20-2)21-3/h4-10H,1-3H3
InChIKey DQNWXURXHQKAAT-UHFFFAOYSA-N
Mol Weight 312.45 g/mol
Molecular Formula C17H16N2S2
Exact Mass 312.075491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LE35SpaS5c3
Name 6-[2,2-bis(methylsulfanyl)ethenyl]-2-methyl-4-phenyl-pyridine-3-carbonitrile
CAS Registry Number 130445-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2S2
InChI InChI=1S/C17H16N2S2/c1-12-16(11-18)15(13-7-5-4-6-8-13)9-14(19-12)10-17(20-2)21-3/h4-10H,1-3H3
InChIKey DQNWXURXHQKAAT-UHFFFAOYSA-N
Molecular Weight 312.449 g/mol
SMILES c1(c(cc(C=C(SC)SC)nc1C)-c1ccccc1)C#N
SPLASH splash10-0002-0091000000-1fa9adbdfd1f03ddc281
Source of Spectrum F-46-3713-15
Synonyms 6-[2,2-bis(methylsulfanyl)vinyl]-2-methyl-4-phenyl-pyridine-3-carbonitrile 6-[2,2-bis(methylthio)ethenyl]-2-methyl-4-phenyl-3-pyridinecarbonitrile 6-[2,2-bis(methylthio)vinyl]-2-methyl-4-phenyl-nicotinonitrile
Wiley ID 1313243