| SpectraBase Spectrum ID |
4eDmSgYSYid |
| Name |
(5,5-Dimethoxy-2-oxidanylidene-furan-3-yl)methyl ethanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
216.063388100 u |
| Formula |
C9H12O6 |
| InChI |
InChI=1S/C9H12O6/c1-6(10)14-5-7-4-9(12-2,13-3)15-8(7)11/h4H,5H2,1-3H3 |
| InChIKey |
XDBOJZYNUYUIME-UHFFFAOYSA-N |
| Molecular Weight |
216.189 g/mol |
| SMILES |
C1(OC(C(=C1)COC(=O)C)=O)(OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.988457 |
