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Methyl (1R,3S)-3-Hydroxy-1-phenylbutane-1-sulfonate

View entire compound with spectra: 1 MS (GC)

Methyl (1R,3S)-3-Hydroxy-1-phenylbutane-1-sulfonate
SpectraBase Compound ID DvP1jNFMCoq
InChI InChI=1S/C11H16O4S/c1-9(12)8-11(16(13,14)15-2)10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3/t9-,11+/m0/s1
InChIKey USJRMJYCNBOQJG-GXSJLCMTSA-N
Mol Weight 244.3 g/mol
Molecular Formula C11H16O4S
Exact Mass 244.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GZtkimCbEIa
Name Methyl (1R,3S)-3-Hydroxy-1-phenylbutane-1-sulfonate
Alternate Name(s) (1R,3S)-3-hydroxy-1-phenyl-1-butanesulfonic acid (1R,3S)-3-hydroxy-1-phenyl-butane-1-sulfonic acid methyl ester Methyl (1R,3S)-3-oxidanyl-1-phenyl-butane-1-sulfonate
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Formula C11H16O4S
InChI InChI=1S/C11H16O4S/c1-9(12)8-11(16(13,14)15-2)10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3/t9-,11+/m0/s1
InChIKey USJRMJYCNBOQJG-GXSJLCMTSA-N
Molecular Weight 244.305 g/mol
SMILES O[C@](C[C@@](S(=O)(=O)OC)(c1ccccc1)[H])(C)[H]
SPLASH splash10-0a4i-2900000000-c595f2fd19b2e95d0f3d
Source of Spectrum C5-2004-592-3
Wiley ID 1616660