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1-[2-(2-mercapto-2-methyl-propyl)phenyl]-2-methyl-propan-2-ol
SpectraBase Compound ID IR9BluXk9jE
InChI InChI=1S/C14H22OS/c1-13(2,15)9-11-7-5-6-8-12(11)10-14(3,4)16/h5-8,15-16H,9-10H2,1-4H3
InChIKey LROWMVUYROVUQJ-UHFFFAOYSA-N
Mol Weight 238.39 g/mol
Molecular Formula C14H22OS
Exact Mass 238.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3InqY2cE0Xt
Name 1-[2-(2-mercapto-2-methyl-propyl)phenyl]-2-methyl-propan-2-ol
Alternate Name(s) 1-[2-(2-mercapto-2-methylpropyl)phenyl]-2-methyl-2-propanol 2-methyl-1-[2-(2-methyl-2-sulfanyl-propyl)phenyl]propan-2-ol 2-methyl-1-[2-(2-methyl-2-sulfanylpropyl)phenyl]-2-propanol
Comments Less than 3 mono-isotopic peaks
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Formula C14H22OS
InChI InChI=1S/C14H22OS/c1-13(2,15)9-11-7-5-6-8-12(11)10-14(3,4)16/h5-8,15-16H,9-10H2,1-4H3
InChIKey LROWMVUYROVUQJ-UHFFFAOYSA-N
Molecular Weight 238.389 g/mol
SMILES SC(Cc1c(CC(O)(C)C)cccc1)(C)C
SPLASH splash10-004i-9100000000-4941da17d7e4df9a6409
Source of Spectrum J-61-1862-9
Wiley ID 1240723