SpectraBase Spectrum ID |
DnMS8W88EC7 |
Name |
1,5-Anhydro-2,3-o-isopropylidene-D-ribose |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
172.073558862 u |
Formula |
C8H12O4 |
InChI |
InChI=1S/C8H12O4/c1-8(2)11-5-4-3-9-7(10-4)6(5)12-8/h4-7H,3H2,1-2H3/t4-,5-,6-,7-/m1/s1 |
InChIKey |
SWWLDMORTIJAQI-DBRKOABJSA-N |
Molecular Weight |
172.180 g/mol |
SMILES |
[C@@]12(O[C@@]([C@@]3([C@]2(OC(O3)(C)C)[H])[H])(CO1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911448 |