| SpectraBase Spectrum ID |
94G39ozyJzN |
| Name |
2,3,6-Tri-O-acetyl-.beta.D-glucopyranosyl isothiocyanate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17NO8S |
| InChI |
InChI=1S/C13H17NO8S/c1-6(15)19-4-9-10(18)11(20-7(2)16)12(21-8(3)17)13(22-9)14-5-23/h9-13,18H,4H2,1-3H3/t9-,10-,11+,12-,13-/m1/s1 |
| InChIKey |
VKAYHTYJDZXSKU-UJPOAAIJSA-N |
| Molecular Weight |
347.338 g/mol |
| SMILES |
O[C@]1([C@@]([C@]([C@@](O[C@@]1(COC(=O)C)[H])(N=C=S)[H])(OC(=O)C)[H])(OC(=O)C)[H])[H] |
| SPLASH |
splash10-004i-0960000000-793045f4b69f942d5df0 |
| Source of Spectrum |
F-48-6420-5 |
| Synonyms |
2,3,6-tri-O-acetyl-N-(thioxomethylene)hexopyranosylamine |
| Wiley ID |
1339847 |
