SpectraBase Spectrum ID |
Araf70weOja |
Name |
Methyl 2,3-di-o-acetyl-4-o-methyl-6-deoxy-.alpha.-D-mannopyranoside |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
276.120902977 u |
Formula |
C12H20O7 |
InChI |
InChI=1S/C12H20O7/c1-6-9(15-4)10(18-7(2)13)11(19-8(3)14)12(16-5)17-6/h6,9-12H,1-5H3/t6-,9-,10+,11+,12+/m1/s1 |
InChIKey |
YAHIQEZSBDYBSD-FDMIMSKNSA-N |
Molecular Weight |
276.285 g/mol |
SMILES |
[C@@]1([C@@]([C@](O[C@@]([C@]1(OC)[H])(C)[H])(OC)[H])(OC(C)=O)[H])(OC(=O)C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.808601 |