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Propanoic acid, 2,2'-[(6-oxidodibenzo[d,f][1,3,2]dioxathiepin-2,10-diyl)bis(oxy)]bis-, dimethyl ester
SpectraBase Compound ID 4A7KgJzIBXc
InChI InChI=1S/C20H20O9S/c1-11(19(21)24-3)26-13-5-7-17-15(9-13)16-10-14(27-12(2)20(22)25-4)6-8-18(16)29-30(23)28-17/h5-12H,1-4H3
InChIKey KKSJGEWEISQKNQ-UHFFFAOYSA-N
Mol Weight 436.43 g/mol
Molecular Formula C20H20O9S
Exact Mass 436.082803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PG5JU2Yuu
Name Propanoic acid, 2,2'-[(6-oxidodibenzo[d,f][1,3,2]dioxathiepin-2,10-diyl)bis(oxy)]bis-, dimethyl ester
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Formula C20H20O9S
InChI InChI=1S/C20H20O9S/c1-11(19(21)24-3)26-13-5-7-17-15(9-13)16-10-14(27-12(2)20(22)25-4)6-8-18(16)29-30(23)28-17/h5-12H,1-4H3
InChIKey KKSJGEWEISQKNQ-UHFFFAOYSA-N
Molecular Weight 436.431 g/mol
SMILES COC(=O)C(C)Oc1ccc2OS(=O)Oc3ccc(OC(C)C(=O)OC)cc3-c2c1
SPLASH splash10-114i-8198500000-5e6d9883858a29f9bcb9
Source of Spectrum JX-2015-4-439
Synonyms Dimethyl 2,2'-((6-oxidodibenzo[d,f][1,3,2]dioxathiepine-2,10-diyl)bis(oxy))dipropanoate Dimethyl 2,2'-[(6-oxidodibenzo[d,f][1,3,2]dioxathiepine-2,10-diyl)bis(oxy)]dipropanoate 2-[[2-(1-methoxy-1-oxopropan-2-yl)oxy-6-oxo-10-benzo[d][1,3,2]benzodioxathiepinyl]oxy]propanoic acid methyl ester Methyl 2-[2-(1-methoxy-1-oxopropan-2-yl)oxy-6-oxobenzo[d][1,3,2]benzodioxathiepin-10-yl]oxypropanoate Methyl 2-[2-(2-methoxy-1-methyl-2-oxo-ethoxy)-6-oxo-benzo[d][1,3,2]benzodioxathiepin-10-yl]oxypropanoate Methyl 2-[2-(1-methoxy-1-oxidanylidene-propan-2-yl)oxy-6-oxidanylidene-benzo[d][1,3,2]benzodioxathiepin-10-yl]oxypropanoate
Wiley ID 1725879