| SpectraBase Spectrum ID |
Gog1cjf3ik3 |
| Name |
.alpha.-D-Altropyranoside, methyl 2-(acetylamino)-6-bromo-2,6-dideoxy-, 3,4-diacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
381.042314981 u |
| Formula |
C13H20BrNO7 |
| InChI |
InChI=1S/C13H20BrNO7/c1-6(16)15-10-12(21-8(3)18)11(20-7(2)17)9(5-14)22-13(10)19-4/h9-13H,5H2,1-4H3,(H,15,16)/t9-,10+,11-,12+,13+/m1/s1 |
| InChIKey |
UCSNMCVLFBZCLV-FHUSYTEZSA-N |
| Molecular Weight |
382.207 g/mol |
| SMILES |
[C@]1([C@@]([C@@](OC)(O[C@@]([C@]1(OC(=O)C)[H])(CBr)[H])[H])(NC(=O)C)[H])(OC(=O)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.83003 |
