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(+)-(2S,3S)-(3-HYDROXY-5-OXO-TETRAHYDROFURAN-2-YL)-METHYL-4-METHYL-BENZENESULFONATE
SpectraBase Compound ID 8xDWWr4yqD1
InChI InChI=1S/C12H14O6S/c1-8-2-4-9(5-3-8)19(15,16)17-7-11-10(13)6-12(14)18-11/h2-5,10-11,13H,6-7H2,1H3/t10-,11+/m0/s1
InChIKey TUJUSSDYSGSBET-WDEREUQCSA-N
Mol Weight 286.3 g/mol
Molecular Formula C12H14O6S
Exact Mass 286.051109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvGbqxZ28s5
Name [(2R,3S)-3-hydroxy-5-oxo-tetrahydrofuran-2-yl]methyl 4-methylbenzenesulfonate
Alternate Name(s) [(2R,3S)-3-hydroxy-5-oxooxolan-2-yl]methyl 4-methylbenzenesulfonate [(2R,3S)-3-oxidanyl-5-oxidanylidene-oxolan-2-yl]methyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid [(2R,3S)-3-hydroxy-5-oxo-2-oxolanyl]methyl ester
CAS Registry Number 91510-99-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O6S
InChI InChI=1S/C12H14O6S/c1-8-2-4-9(5-3-8)19(15,16)17-7-11-10(13)6-12(14)18-11/h2-5,10-11,13H,6-7H2,1H3/t10-,11+/m0/s1
InChIKey TUJUSSDYSGSBET-WDEREUQCSA-N
Molecular Weight 286.298 g/mol
SMILES O[C@]1(CC(O[C@@]1(COS(c1ccc(cc1)C)(=O)=O)[H])=O)[H]
SPLASH splash10-052f-9720000000-0404c9748a2501902f18
Source of Spectrum Y-21-330-0
Wiley ID 1289368