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2-[(2R,3R,4S)-2-methyl-5-oxidanylidene-4-(phenylsulfonyl)oxolan-3-yl]ethanoic acid
SpectraBase Compound ID E4SiuRZvzIH
InChI InChI=1S/C13H14O6S/c1-8-10(7-11(14)15)12(13(16)19-8)20(17,18)9-5-3-2-4-6-9/h2-6,8,10,12H,7H2,1H3,(H,14,15)/t8-,10-,12+/m1/s1
InChIKey CNLNAXLXSKJEPW-UISBYWKRSA-N
Mol Weight 298.31 g/mol
Molecular Formula C13H14O6S
Exact Mass 298.051109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IiTlmSjuFiY
Name 2-[(2R,3R,4S)-2-methyl-5-oxidanylidene-4-(phenylsulfonyl)oxolan-3-yl]ethanoic acid
Alternate Name(s) 2-[(2R,3R,4S)-4-(benzenesulfonyl)-2-methyl-5-oxo-3-oxolanyl]acetic acid 2-[(2R,3R,4S)-4-(benzenesulfonyl)-2-methyl-5-oxo-tetrahydrofuran-3-yl]acetic acid 2-[(2R,3R,4S)-4-(benzenesulfonyl)-2-methyl-5-oxooxolan-3-yl]acetic acid 2-[(2R,3R,4S)-4-besyl-5-keto-2-methyl-tetrahydrofuran-3-yl]acetic acid
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Formula C13H14O6S
InChI InChI=1S/C13H14O6S/c1-8-10(7-11(14)15)12(13(16)19-8)20(17,18)9-5-3-2-4-6-9/h2-6,8,10,12H,7H2,1H3,(H,14,15)/t8-,10-,12+/m1/s1
InChIKey CNLNAXLXSKJEPW-UISBYWKRSA-N
Molecular Weight 298.309 g/mol
SMILES OC(C[C@]1([C@](S(=O)(=O)c2ccccc2)(C(O[C@@]1(C)[H])=O)[H])[H])=O
SPLASH splash10-004i-9200000000-0f49bcb76be9889b75c4
Source of Spectrum J-59-8088-21
Wiley ID 1300577