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Benzene, [(2-methyl-1-methylene-2,5-hexadienyl)thio]-, (E)-
SpectraBase Compound ID 8JdM0Snbepq
InChI InChI=1S/C14H16S/c1-4-5-9-12(2)13(3)15-14-10-7-6-8-11-14/h4,6-11H,1,3,5H2,2H3/b12-9+
InChIKey SDHTVXXHQNZGRN-FMIVXFBMSA-N
Mol Weight 216.34 g/mol
Molecular Formula C14H16S
Exact Mass 216.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwG8qNpSz21
Name Benzene, [(2-methyl-1-methylene-2,5-hexadienyl)thio]-, (E)-
CAS Registry Number 110027-00-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16S
InChI InChI=1S/C14H16S/c1-4-5-9-12(2)13(3)15-14-10-7-6-8-11-14/h4,6-11H,1,3,5H2,2H3/b12-9+
InChIKey SDHTVXXHQNZGRN-FMIVXFBMSA-N
Molecular Weight 216.342 g/mol
SMILES C(Sc1ccccc1)(\C(=C\CC=C)C)=C
SPLASH splash10-05p9-3940000000-fedbd6fa7a405f239bd0
Source of Spectrum J-52-4470-4
Synonyms (2E)-2-methyl-1-methylene-2,5-hexadienyl phenyl sulfide (E)-3-Methyl-2-(phenylthio)-1,3,6-heptatriene {[(2E)-2-methyl-1-methylene-2,5-hexadienyl]sulfanyl}benzene
Wiley ID 1215952