| SpectraBase Spectrum ID |
377vT9xOgjS |
| Name |
1-Deoxy-2,3:5,6-di-o-isopropylidene-4-o-methyl-D-glucitol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.162373868 u |
| Formula |
C13H24O5 |
| InChI |
InChI=1S/C13H24O5/c1-8-10(18-13(4,5)16-8)11(14-6)9-7-15-12(2,3)17-9/h8-11H,7H2,1-6H3 |
| InChIKey |
FLCAUKWABRVFDY-UHFFFAOYSA-N |
| Molecular Weight |
260.330 g/mol |
| SMILES |
C1(OC(C)(C)OC1C(OC)C1OC(C)(C)OC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916447 |
