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(4-Cyanophenyl)(3-(styrylthio)propyl)sulfane
SpectraBase Compound ID 9atPTv9h1yY
InChI InChI=1S/C18H17NS2/c19-15-17-7-9-18(10-8-17)21-13-4-12-20-14-11-16-5-2-1-3-6-16/h1-3,5-11,14H,4,12-13H2/b14-11+
InChIKey LRDUTYUNFRAWDA-SDNWHVSQSA-N
Mol Weight 311.46 g/mol
Molecular Formula C18H17NS2
Exact Mass 311.080242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JOkT9avQf1v
Name (4-Cyanophenyl)(3-(styrylthio)propyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NS2
InChI InChI=1S/C18H17NS2/c19-15-17-7-9-18(10-8-17)21-13-4-12-20-14-11-16-5-2-1-3-6-16/h1-3,5-11,14H,4,12-13H2/b14-11+
InChIKey LRDUTYUNFRAWDA-SDNWHVSQSA-N
Literature Reference DOI 10.1021/acs.joc.5b00547
Molecular Weight 311.461 g/mol
SMILES c1cc(\C=C\SCCCSc2ccc(cc2)C#N)ccc1
SPLASH splash10-03di-3809000000-80d5ceedc1d7809bd410
Source of Spectrum J-80-4128-14
Synonyms (E)-4-((3-(styrylthio)propyl)thio)benzonitrile
Wiley ID 1761291