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(4R,5S)-5-(1,3-benzodioxol-5-yl)-2-keto-1,3,2-dioxathiolane-4-carboxylic acid ethyl ester
SpectraBase Compound ID EkQpziz7Ucc
InChI InChI=1S/C12H12O7S/c1-2-15-12(13)11-10(18-20(14)19-11)7-3-4-8-9(5-7)17-6-16-8/h3-5,10-11H,2,6H2,1H3/t10-,11+,20?/m0/s1
InChIKey OOEWFJCBADYYAJ-XHKQKSICSA-N
Mol Weight 300.28 g/mol
Molecular Formula C12H12O7S
Exact Mass 300.030374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2h9lTgadgO
Name (4R,5S)-5-(1,3-benzodioxol-5-yl)-2-keto-1,3,2-dioxathiolane-4-carboxylic acid ethyl ester
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Formula C12H12O7S
InChI InChI=1S/C12H12O7S/c1-2-15-12(13)11-10(18-20(14)19-11)7-3-4-8-9(5-7)17-6-16-8/h3-5,10-11H,2,6H2,1H3/t10-,11+,20?/m0/s1
InChIKey OOEWFJCBADYYAJ-XHKQKSICSA-N
Molecular Weight 300.281 g/mol
SMILES [C@@]1(O[S@@](O[C@]1(c1cc2OCOc2cc1)[H])=O)(C(=O)OCC)[H]
SPLASH splash10-03gr-3900000000-a375b5070878bd13b51a
Source of Spectrum KD-15-3113-5
Synonyms (4R,5S)-5-(1,3-benzodioxol-5-yl)-2-oxo-1,3,2-dioxathiolane-4-carboxylic acid ethyl ester Ethyl (4R,5S)-5-(1,3-benzodioxol-5-yl)-2-oxidanylidene-1,3,2-dioxathiolane-4-carboxylate Ethyl (4R,5S)-5-(1,3-benzodioxol-5-yl)-2-oxo-1,3,2-dioxathiolane-4-carboxylate
Wiley ID 1637289