| SpectraBase Spectrum ID |
B9mPfZ4nBDO |
| Name |
Carbonic acid, 3,4-diacetoxy-5-acetoxymethyl-2-tetrahydrofuryl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.074346705 u |
| Formula |
C12H16O10 |
| InChI |
InChI=1S/C12H16O10/c1-5(13)18-4-8-9(19-6(2)14)10(20-7(3)15)11(21-8)22-12(16)17/h8-11H,4H2,1-3H3,(H,16,17)/t8-,9-,10-,11-/m1/s1 |
| InChIKey |
ZMFPMGLQGQUKQV-GWOFURMSSA-N |
| Molecular Weight |
320.250 g/mol |
| SMILES |
[C@]1([C@](O[C@@]([C@]1(OC(C)=O)[H])(COC(C)=O)[H])(OC(=O)O)[H])(OC(C)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969319 |
