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2-[(2R,3R,4S)-2-methyl-5-oxidanylidene-4-phenylsulfanyl-oxolan-3-yl]ethanoic acid
SpectraBase Compound ID J82KxI5FzTS
InChI InChI=1S/C13H14O4S/c1-8-10(7-11(14)15)12(13(16)17-8)18-9-5-3-2-4-6-9/h2-6,8,10,12H,7H2,1H3,(H,14,15)/t8-,10-,12+/m1/s1
InChIKey ZIUGXMLIZGSYAJ-UISBYWKRSA-N
Mol Weight 266.31 g/mol
Molecular Formula C13H14O4S
Exact Mass 266.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uh9IOgd2oj
Name 2-[(2R,3R,4S)-2-methyl-5-oxidanylidene-4-phenylsulfanyl-oxolan-3-yl]ethanoic acid
Alternate Name(s) 2-[(2R,3R,4S)-2-methyl-5-oxo-4-(phenylthio)-3-oxolanyl]acetic acid 2-[(2R,3R,4S)-2-methyl-5-oxo-4-phenylsulfanyl-tetrahydrofuran-3-yl]acetic acid 2-[(2R,3R,4S)-5-keto-2-methyl-4-(phenylthio)tetrahydrofuran-3-yl]acetic acid
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Formula C13H14O4S
InChI InChI=1S/C13H14O4S/c1-8-10(7-11(14)15)12(13(16)17-8)18-9-5-3-2-4-6-9/h2-6,8,10,12H,7H2,1H3,(H,14,15)/t8-,10-,12+/m1/s1
InChIKey ZIUGXMLIZGSYAJ-UISBYWKRSA-N
Molecular Weight 266.311 g/mol
SMILES OC(C[C@]1([C@@](C(O[C@@]1(C)[H])=O)(Sc1ccccc1)[H])[H])=O
SPLASH splash10-02t9-1490000000-1edbeee908cc536103c3
Source of Spectrum J-59-8087-20
Wiley ID 1269670