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Benzene, [(1,2,5-trimethyl-2-hexenyl)thio]-, (E)-
SpectraBase Compound ID Ba78kfROLGk
InChI InChI=1S/C15H22S/c1-12(2)10-11-13(3)14(4)16-15-8-6-5-7-9-15/h5-9,11-12,14H,10H2,1-4H3/b13-11+
InChIKey CTCJGSVAVOUCPZ-ACCUITESSA-N
Mol Weight 234.4 g/mol
Molecular Formula C15H22S
Exact Mass 234.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0aqKY3ZCe0
Name Benzene, [(1,2,5-trimethyl-2-hexenyl)thio]-, (E)-
CAS Registry Number 63996-71-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22S
InChI InChI=1S/C15H22S/c1-12(2)10-11-13(3)14(4)16-15-8-6-5-7-9-15/h5-9,11-12,14H,10H2,1-4H3/b13-11+
InChIKey CTCJGSVAVOUCPZ-ACCUITESSA-N
Molecular Weight 234.401 g/mol
SMILES C(\C(=C\CC(C)C)C)(Sc1ccccc1)C
SPLASH splash10-02w9-7910000000-f493b56548e531e5191d
Source of Spectrum KC-1977-1139-0
Synonyms 3,6-Dimethyl-2-(phenylthio)hept-3-ene phenyl (2E)-1,2,5-trimethyl-2-hexenyl sulfide {[(2E)-1,2,5-trimethyl-2-hexenyl]sulfanyl}benzene
Wiley ID 1236520