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(Ss,3aR,8bR)-(+)-3a,8b-Dihydro-7-hydroxy-8-(p-tolylsulfinyl)furo[3,2-b]benzofuran-2(3H)-one
SpectraBase Compound ID Ew1bCSkX7ju
InChI InChI=1S/C17H14O5S/c1-9-2-4-10(5-3-9)23(20)17-11(18)6-7-12-15(17)16-13(21-12)8-14(19)22-16/h2-7,13,16,18H,8H2,1H3/t13-,16+,23?/m1/s1
InChIKey XHLQUXAJAVQHJE-PQDXNVRXSA-N
Mol Weight 330.35 g/mol
Molecular Formula C17H14O5S
Exact Mass 330.056195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Qjt0aSGSFY
Name (Ss,3aR,8bR)-(+)-3a,8b-Dihydro-7-hydroxy-8-(p-tolylsulfinyl)furo[3,2-b]benzofuran-2(3H)-one
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Formula C17H14O5S
InChI InChI=1S/C17H14O5S/c1-9-2-4-10(5-3-9)23(20)17-11(18)6-7-12-15(17)16-13(21-12)8-14(19)22-16/h2-7,13,16,18H,8H2,1H3/t13-,16+,23?/m1/s1
InChIKey XHLQUXAJAVQHJE-PQDXNVRXSA-N
Molecular Weight 330.354 g/mol
SMILES Oc1c(c2[C@@]3([C@](CC(O3)=O)([H])Oc2cc1)[H])[S@](c1ccc(cc1)C)=O
SPLASH splash10-001i-0029000000-0f323a48d3dc26d896e7
Source of Spectrum QC-6-268-3
Synonyms (3aR,8bR)-7-hydroxy-8-[(S)-(4-methylphenyl)sulfinyl]-3a,8b-dihydro-3H-furo[3,2-b]benzofuran-2-one (3aR,8bR)-7-hydroxy-8-[(S)-(4-methylphenyl)sulfinyl]-3a,8b-dihydro-3H-furo[3,2-b][1]benzofuran-2-one (3aR,8bR)-8-[(S)-(4-methylphenyl)sulfinyl]-7-oxidanyl-3a,8b-dihydro-3H-furo[3,2-b][1]benzofuran-2-one
Wiley ID 868735