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2-[(2R,3R,4S)-2-[(E)-4-acetoxybut-2-enyl]-5-keto-4-(phenylthio)tetrahydrofuran-3-yl]acetic acid methyl ester
SpectraBase Compound ID LhMSbrDIxZO
InChI InChI=1S/C19H22O6S/c1-13(20)24-11-7-6-10-16-15(12-17(21)23-2)18(19(22)25-16)26-14-8-4-3-5-9-14/h3-9,15-16,18H,10-12H2,1-2H3/b7-6+/t15-,16-,18+/m1/s1
InChIKey IIRWUXJMSQSUGL-FYFHTKEFSA-N
Mol Weight 378.44 g/mol
Molecular Formula C19H22O6S
Exact Mass 378.11371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlCdEcg1Btj
Name 2-[(2R,3R,4S)-2-[(E)-4-acetoxybut-2-enyl]-5-keto-4-(phenylthio)tetrahydrofuran-3-yl]acetic acid methyl ester
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Formula C19H22O6S
InChI InChI=1S/C19H22O6S/c1-13(20)24-11-7-6-10-16-15(12-17(21)23-2)18(19(22)25-16)26-14-8-4-3-5-9-14/h3-9,15-16,18H,10-12H2,1-2H3/b7-6+/t15-,16-,18+/m1/s1
InChIKey IIRWUXJMSQSUGL-FYFHTKEFSA-N
Molecular Weight 378.439 g/mol
SMILES C1([C@]([C@](CC(=O)OC)([C@](O1)(C\C=C\COC(=O)C)[H])[H])(Sc1ccccc1)[H])=O
SPLASH splash10-05ot-0906000000-29b49c96c24d9488a645
Source of Spectrum J-59-4471-41
Synonyms 2-[(2R,3R,4S)-2-[(E)-4-acetyloxybut-2-enyl]-5-oxo-4-(phenylthio)-3-oxolanyl]acetic acid methyl ester Methyl 2-[(2R,3R,4S)-2-[(E)-4-acetoxybut-2-enyl]-5-oxo-4-phenylsulfanyl-tetrahydrofuran-3-yl]acetate Methyl 2-[(2R,3R,4S)-2-[(E)-4-acetyloxybut-2-enyl]-5-oxidanylidene-4-phenylsulfanyl-oxolan-3-yl]ethanoate Methyl 2-[(2R,3R,4S)-2-[(E)-4-acetyloxybut-2-enyl]-5-oxo-4-phenylsulfanyloxolan-3-yl]acetate
Wiley ID 1358648