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2-Hexyl phenyl sulfide
SpectraBase Compound ID Bm7qtOHHdN7
InChI InChI=1S/C12H18S/c1-3-4-8-11(2)13-12-9-6-5-7-10-12/h5-7,9-11H,3-4,8H2,1-2H3
InChIKey YVEXMCBQNOKZBF-UHFFFAOYSA-N
Mol Weight 194.34 g/mol
Molecular Formula C12H18S
Exact Mass 194.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lTiIevU7HG
Name 2-Hexyl phenyl sulfide
Alternate Name(s) 1-Methylpentyl phenyl sulfide [(1-Methylpentyl)sulfanyl]benzene (hexan-2-ylthio)benzene 1-Methylpentylsulfanylbenzene Hexan-2-ylsulfanylbenzene
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Formula C12H18S
InChI InChI=1S/C12H18S/c1-3-4-8-11(2)13-12-9-6-5-7-10-12/h5-7,9-11H,3-4,8H2,1-2H3
InChIKey YVEXMCBQNOKZBF-UHFFFAOYSA-N
Molecular Weight 194.336 g/mol
SMILES c1(SC(CCCC)C)ccccc1
SPLASH splash10-03dl-3900000000-0a62906ab43b40040840
Source of Spectrum J-59-3492-0
Wiley ID 1191282