| SpectraBase Spectrum ID |
9BCbrlPwT2 |
| Name |
1,2:5,6-di-o-Isopropylidene-D-mannitol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.141638422 u |
| Formula |
C12H22O6 |
| InChI |
InChI=1S/C12H22O6/c1-11(2)15-5-7(17-11)9(13)10(14)8-6-16-12(3,4)18-8/h7-10,13-14H,5-6H2,1-4H3/t7-,8-,9-,10-/m1/s1 |
| InChIKey |
ODYBCPSCYHAGHA-ZYUZMQFOSA-N |
| Molecular Weight |
262.302 g/mol |
| SMILES |
C1OC(O[C@]1([C@]([C@@]([C@]1(COC(O1)(C)C)[H])(O)[H])(O)[H])[H])(C)C |
| Spectrum/Structure Validation Score (Raman) |
0.978688 |
