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2-Benzyl-6-(t-butyl)-2-(methylthio)cyclohexanol
SpectraBase Compound ID 3WubRDZAfHF
InChI InChI=1S/C18H28OS/c1-17(2,3)15-11-8-12-18(20-4,16(15)19)13-14-9-6-5-7-10-14/h5-7,9-10,15-16,19H,8,11-13H2,1-4H3
InChIKey MHNDWFBDXBVXOD-UHFFFAOYSA-N
Mol Weight 292.48 g/mol
Molecular Formula C18H28OS
Exact Mass 292.186087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Kz9rOhxwFV
Name 2-Benzyl-6-(t-butyl)-2-(methylthio)cyclohexanol
Alternate Name(s) 2-Benzyl-6-(t-butyl)-2-(methylthio)-1-cyclohexanol 2-benzyl-6-tert-butyl-2-(methylsulfanyl)cyclohexanol
Comments Less than 3 mono-isotopic peaks
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Formula C18H28OS
InChI InChI=1S/C18H28OS/c1-17(2,3)15-11-8-12-18(20-4,16(15)19)13-14-9-6-5-7-10-14/h5-7,9-10,15-16,19H,8,11-13H2,1-4H3
InChIKey MHNDWFBDXBVXOD-UHFFFAOYSA-N
Molecular Weight 292.481 g/mol
SMILES OC1C(Cc2ccccc2)(SC)CCCC1C(C)(C)C
SPLASH splash10-0a4i-9040000000-2befdc307c0878126e23
Source of Spectrum Y4-88-599-9
Wiley ID 1550279