| SpectraBase Spectrum ID |
Fn6yaT42CX4 |
| Name |
3-Desoxy-3-acetoxymethyl-1,7-diacetyl-2,5:4,6-dimethylene-D-glycero-D-mannitol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
376.136946963 u |
| Formula |
C16H24O10 |
| InChI |
InChI=1S/C16H24O10/c1-9(17)20-4-12-13(5-21-10(2)18)23-7-26-16-14(6-22-11(3)19)24-8-25-15(12)16/h12-16H,4-8H2,1-3H3 |
| InChIKey |
RSKLDZLQXLYEIR-UHFFFAOYSA-N |
| Molecular Weight |
376.358 g/mol |
| SMILES |
C1(C2C(OCO1)C(C(COC(C)=O)OCO2)COC(=O)C)COC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961838 |
