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cis-8-Carbomethoxy-7-hydroxy-2-oxo-2,3,3a,8b-tetrahydro-1H-[1]benzofuro[3,2-b]thiophene
SpectraBase Compound ID D1b1DmH3BUJ
InChI InChI=1S/C12H10O5S/c1-16-12(15)9-5(13)2-3-6-10(9)11-7(17-6)4-8(14)18-11/h2-3,7,11,13H,4H2,1H3/t7-,11+/m0/s1
InChIKey JALGGZQOFLIUOY-WRWORJQWSA-N
Mol Weight 266.27 g/mol
Molecular Formula C12H10O5S
Exact Mass 266.024895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8gQ5x5QODP
Name cis-8-Carbomethoxy-7-hydroxy-2-oxo-2,3,3a,8b-tetrahydro-1H-[1]benzofuro[3,2-b]thiophene
Alternate Name(s) Methyl (3aS,8bS)-7-hydroxy-2-oxo-2,3,3a,8b-tetrahydrothieno[3,2-b][1]benzofuran-8-carboxylate
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Formula C12H10O5S
InChI InChI=1S/C12H10O5S/c1-16-12(15)9-5(13)2-3-6-10(9)11-7(17-6)4-8(14)18-11/h2-3,7,11,13H,4H2,1H3/t7-,11+/m0/s1
InChIKey JALGGZQOFLIUOY-WRWORJQWSA-N
Molecular Weight 266.267 g/mol
SMILES Oc1ccc2O[C@@]3([C@@](SC(C3)=O)(c2c1C(=O)OC)[H])[H]
SPLASH splash10-0159-0090000000-ed6c7b34ab3cc9d6fc87
Source of Spectrum F-62-3025-13
Wiley ID 1632751