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3-O-Acetyl-5,6-O,S-carbonyl-1,2-isopropylidene-6-thio-,beta.L-idofuranose
SpectraBase Compound ID GJD0DxIyQHd
InChI InChI=1S/C12H16O7S/c1-5(13)15-8-7(6-4-20-11(14)16-6)17-10-9(8)18-12(2,3)19-10/h6-10H,4H2,1-3H3
InChIKey ICZWTKUWWKRWKV-UHFFFAOYSA-N
Mol Weight 304.31 g/mol
Molecular Formula C12H16O7S
Exact Mass 304.061674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHVsx5z6w2m
Name 3-O-Acetyl-5,6-O,S-carbonyl-1,2-isopropylidene-6-thio-,beta.L-idofuranose
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O7S
InChI InChI=1S/C12H16O7S/c1-5(13)15-8-7(6-4-20-11(14)16-6)17-10-9(8)18-12(2,3)19-10/h6-10H,4H2,1-3H3
InChIKey ICZWTKUWWKRWKV-UHFFFAOYSA-N
Molecular Weight 304.313 g/mol
SMILES C12C(OC(C2OC(=O)C)C2OC(=O)SC2)OC(O1)(C)C
SPLASH splash10-000i-0090000000-d4b7d661dbd8a593b527
Source of Spectrum E1-44-1473-7
Synonyms acetic acid [2,2-dimethyl-5-(2-oxo-1,3-oxathiolan-5-yl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] ester [2,2-dimethyl-5-(2-oxo-1,3-oxathiolan-5-yl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate [2,2-dimethyl-5-(2-oxidanylidene-1,3-oxathiolan-5-yl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] ethanoate
Wiley ID 1553467