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Benzene, [(2-methyl-2-cyclohexen-1-yl)thio]-, (.+-.)-
SpectraBase Compound ID JPVLoSQ7PdU
InChI InChI=1S/C13H16S/c1-11-7-5-6-10-13(11)14-12-8-3-2-4-9-12/h2-4,7-9,13H,5-6,10H2,1H3
InChIKey WIPPVHKPPPIOSJ-UHFFFAOYSA-N
Mol Weight 204.33 g/mol
Molecular Formula C13H16S
Exact Mass 204.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDY9yvQFVUG
Name Benzene, [(2-methyl-2-cyclohexen-1-yl)thio]-, (.+-.)-
CAS Registry Number 125334-71-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16S
InChI InChI=1S/C13H16S/c1-11-7-5-6-10-13(11)14-12-8-3-2-4-9-12/h2-4,7-9,13H,5-6,10H2,1H3
InChIKey WIPPVHKPPPIOSJ-UHFFFAOYSA-N
Molecular Weight 204.331 g/mol
SMILES C=1(C(Sc2ccccc2)CCCC1)C
SPLASH splash10-0005-9100000000-d98a032ed8d1895b9d8b
Source of Spectrum KC-1989-306-9
Synonyms 1-(Phenylthiomethyl)cyclohexene 1-Methyl-6-phenylthiocyclohex-1-ene 2-Methyl-2-cyclohexen-1-yl phenyl sulfide [(2-methyl-2-cyclohexen-1-yl)sulfanyl]benzene
Wiley ID 1202188