| SpectraBase Spectrum ID |
CJtTcy6PrZw |
| Name |
Benzyl N,3,4,6-tetra-o-acetyl-.alpha.-D-mannosaminide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
437.168581444 u |
| Formula |
C21H27NO9 |
| InChI |
InChI=1S/C21H27NO9/c1-12(23)22-18-20(30-15(4)26)19(29-14(3)25)17(11-27-13(2)24)31-21(18)28-10-16-8-6-5-7-9-16/h5-9,17-21H,10-11H2,1-4H3,(H,22,23)/t17-,18+,19-,20-,21+/m1/s1 |
| InChIKey |
IDEBBPWXWFHKBU-XNTOXWQXSA-N |
| Molecular Weight |
437.445 g/mol |
| SMILES |
[C@@]1([C@](O[C@@]([C@]([C@]1(OC(=O)C)[H])(NC(=O)C)[H])(OCC1=CC=CC=C1)[H])(COC(=O)C)[H])(OC(=O)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973229 |
