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1-[2-(Mercaptomethyl)phenyl]-2-methyl-2-propanol
SpectraBase Compound ID CS00jof4VvY
InChI InChI=1S/C11H16OS/c1-11(2,12)7-9-5-3-4-6-10(9)8-13/h3-6,12-13H,7-8H2,1-2H3
InChIKey QJSPLMUMCWLBKG-UHFFFAOYSA-N
Mol Weight 196.31 g/mol
Molecular Formula C11H16OS
Exact Mass 196.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8b6HRVEaZti
Name 1-[2-(Mercaptomethyl)phenyl]-2-methyl-2-propanol
Comments Less than 3 mono-isotopic peaks
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Formula C11H16OS
InChI InChI=1S/C11H16OS/c1-11(2,12)7-9-5-3-4-6-10(9)8-13/h3-6,12-13H,7-8H2,1-2H3
InChIKey QJSPLMUMCWLBKG-UHFFFAOYSA-N
Molecular Weight 196.308 g/mol
SMILES OC(Cc1c(CS)cccc1)(C)C
SPLASH splash10-0006-9000000000-4b2f78750033b9b165f0
Source of Spectrum J-61-1861-3
Synonyms 1-[2-(mercaptomethyl)phenyl]-2-methyl-propan-2-ol 2-methyl-1-[2-(sulfanylmethyl)phenyl]-2-propanol 2-methyl-1-[2-(sulfanylmethyl)phenyl]propan-2-ol
Wiley ID 1193049