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(R)-2,3-dihydroxy-3-methylbutyl p-toluenesulfonate
SpectraBase Compound ID KFhsAG75W4b
InChI InChI=1S/C12H18O5S/c1-9-4-6-10(7-5-9)18(15,16)17-8-11(13)12(2,3)14/h4-7,11,13-14H,8H2,1-3H3/t11-/m1/s1
InChIKey QAAVLHVZKTUTCM-LLVKDONJSA-N
Mol Weight 274.33 g/mol
Molecular Formula C12H18O5S
Exact Mass 274.087495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfKqcAubtH5
Name (R)-2,3-dihydroxy-3-methylbutyl p-toluenesulfonate
Alternate Name(s) (R)-2,3-dihydroxy-3-methylbutyl 4-methylbenzenesulfonate
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Formula C12H18O5S
InChI InChI=1S/C12H18O5S/c1-9-4-6-10(7-5-9)18(15,16)17-8-11(13)12(2,3)14/h4-7,11,13-14H,8H2,1-3H3/t11-/m1/s1
InChIKey QAAVLHVZKTUTCM-LLVKDONJSA-N
Literature Reference DOI 10.1002/prac.19903320209
Molecular Weight 274.331 g/mol
SMILES OC([C@@](COS(c1ccc(cc1)C)(=O)=O)(O)[H])(C)C
SPLASH splash10-0a4i-9470000000-f58f100f50b21ea65cb7
Source of Spectrum JF-332-196-8a
Wiley ID 1789625