| SpectraBase Spectrum ID |
C2AGhj3kxFA |
| Name |
Methyl 2-o-N-butyl-3,4-dideoxy-.alpha.,D-glucopyranoside |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.151809184 u |
| Formula |
C11H22O4 |
| InChI |
InChI=1S/C11H22O4/c1-3-4-7-14-10-6-5-9(8-12)15-11(10)13-2/h9-12H,3-8H2,1-2H3/t9-,10+,11-/m0/s1 |
| InChIKey |
IXXDCTIBBJKJAQ-AXFHLTTASA-N |
| Molecular Weight |
218.293 g/mol |
| SMILES |
[C@]1(O[C@@](CC[C@]1(OCCCC)[H])(CO)[H])(OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929486 |
