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6-[1'-(PHENYLSULFANYL)-CYCLOHEXYL]-HEXANE-1,6-DIOL
SpectraBase Compound ID 76QPt9RT8FA
InChI InChI=1S/C18H28O2S/c19-15-9-2-6-12-17(20)18(13-7-3-8-14-18)21-16-10-4-1-5-11-16/h1,4-5,10-11,17,19-20H,2-3,6-9,12-15H2
InChIKey WCMJESZDHYFRGS-UHFFFAOYSA-N
Mol Weight 308.48 g/mol
Molecular Formula C18H28O2S
Exact Mass 308.181001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uBcLGuxP3J
Name 6-[1'-(Phenylsulfayl)cyclohexyl]hexane-1,6-diol
Alternate Name(s) 6-[1'-(Phenylsulfanyl)cyclohexyl]hexane-1,6-diol 1-(1-phenylsulfanylcyclohexyl)hexane-1,6-diol
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Formula C18H28O2S
InChI InChI=1S/C18H28O2S/c19-15-9-2-6-12-17(20)18(13-7-3-8-14-18)21-16-10-4-1-5-11-16/h1,4-5,10-11,17,19-20H,2-3,6-9,12-15H2
InChIKey WCMJESZDHYFRGS-UHFFFAOYSA-N
Molecular Weight 308.480 g/mol
SMILES OC(CCCCCO)C1(Sc2ccccc2)CCCCC1
SPLASH splash10-001i-9701000000-d183f9ed77359fdaa046
Source of Spectrum KC-0-2776-8
Wiley ID 829108