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(2,6,6-trimethylcyclohexen-1-yl)methylsulfanylbenzene
SpectraBase Compound ID 3JDBxpWrYar
InChI InChI=1S/C16H22S/c1-13-8-7-11-16(2,3)15(13)12-17-14-9-5-4-6-10-14/h4-6,9-10H,7-8,11-12H2,1-3H3
InChIKey YWWFRHXUONMUCJ-UHFFFAOYSA-N
Mol Weight 246.41 g/mol
Molecular Formula C16H22S
Exact Mass 246.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID At2Nn5DTkkD
Name (2,6,6-trimethylcyclohexen-1-yl)methylsulfanylbenzene
Alternate Name(s) {[(2,6,6-Trimethyl-1-cyclohexen-1-yl)methyl]thio}benzene [(2,6,6-trimethyl-1-cyclohexenyl)methylthio]benzene [(2,6,6-trimethylcyclohexen-1-yl)methylthio]benzene Phenyl((2,6,6-trimethylcyclohex-1-en-1-yl)methyl)sulfane
Comments Less than 3 mono-isotopic peaks
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Formula C16H22S
InChI InChI=1S/C16H22S/c1-13-8-7-11-16(2,3)15(13)12-17-14-9-5-4-6-10-14/h4-6,9-10H,7-8,11-12H2,1-3H3
InChIKey YWWFRHXUONMUCJ-UHFFFAOYSA-N
Molecular Weight 246.412 g/mol
SMILES C1(=C(CCCC1(C)C)C)CSc1ccccc1
SPLASH splash10-000j-0960000000-31e9a949934b4bdebba2
Source of Spectrum F-56-3930-0
Wiley ID 857130