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2-Benzyl-1-phenylthiopenta- 1(E),4-diene
SpectraBase Compound ID ywZYtw7y8o
InChI InChI=1S/C18H18S/c1-2-9-17(14-16-10-5-3-6-11-16)15-19-18-12-7-4-8-13-18/h2-8,10-13,15H,1,9,14H2/b17-15+
InChIKey OQNCRPANSUBZGY-BMRADRMJSA-N
Mol Weight 266.4 g/mol
Molecular Formula C18H18S
Exact Mass 266.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQGXgfAhmpo
Name 2-Benzyl-1-phenylthiopenta- 1(E),4-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18S
InChI InChI=1S/C18H18S/c1-2-9-17(14-16-10-5-3-6-11-16)15-19-18-12-7-4-8-13-18/h2-8,10-13,15H,1,9,14H2/b17-15+
InChIKey OQNCRPANSUBZGY-BMRADRMJSA-N
Literature Reference DOI 10.1021/ol062686r
Molecular Weight 266.402 g/mol
SMILES c1(ccccc1)S\C=C\(Cc1ccccc1)CC=C
SPLASH splash10-0006-9230000000-88b4854d0fd09453782a
Source of Spectrum A1-9-263/SMS5-4ka
Synonyms (E)-(2-benzylpenta-1,4-dien-1-yl)(phenyl)sulfane
Wiley ID 1757775