| SpectraBase Spectrum ID |
LACtBZTLUJ7 |
| Name |
2,5-Monoformal-L-rhamnitol triacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.095082151 u |
| Formula |
C13H18O9 |
| InChI |
InChI=1S/C13H18O9/c1-6-11(20-8(3)15)12(21-9(4)16)10(5-18-7(2)14)22-13(17)19-6/h6,10-12H,5H2,1-4H3 |
| InChIKey |
GNNJPEHNQBWELX-UHFFFAOYSA-N |
| Molecular Weight |
318.278 g/mol |
| SMILES |
C1(C(OC(OC(C1OC(C)=O)C)=O)COC(C)=O)OC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948171 |
