| 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)
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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 |
| Alternate Name(s) | 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 |
| 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 |
| Wiley ID | 1553467 |