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Benzene, [[(6-methyl-1-cyclohexen-1-yl)methyl]thio]-, (.+-.)-
SpectraBase Compound ID 4wanHMIikUh
InChI InChI=1S/C14H18S/c1-12-7-5-6-8-13(12)11-15-14-9-3-2-4-10-14/h2-4,8-10,12H,5-7,11H2,1H3
InChIKey ATCQCSBSFXJZIL-UHFFFAOYSA-N
Mol Weight 218.36 g/mol
Molecular Formula C14H18S
Exact Mass 218.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Crr9mRAmGb
Name Benzene, [[(6-methyl-1-cyclohexen-1-yl)methyl]thio]-, (.+-.)-
CAS Registry Number 125334-81-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18S
InChI InChI=1S/C14H18S/c1-12-7-5-6-8-13(12)11-15-14-9-3-2-4-10-14/h2-4,8-10,12H,5-7,11H2,1H3
InChIKey ATCQCSBSFXJZIL-UHFFFAOYSA-N
Molecular Weight 218.358 g/mol
SMILES C1(CSc2ccccc2)=CCCCC1C
SPLASH splash10-0aor-5910000000-5ff2c565b0371820411c
Source of Spectrum KC-1989-310-33
Synonyms (6-methyl-1-cyclohexen-1-yl)methyl phenyl sulfide 6-Methyl-1-(phenylthiomethyl)cyclohexene {[(6-methyl-1-cyclohexen-1-yl)methyl]sulfanyl}benzene
Wiley ID 1218084