| SpectraBase Spectrum ID |
DRirQpuDUzq |
| Name |
Propanedioic acid, (3-methoxy-2-propenylidene)-, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
200.068473481 u |
| Formula |
C9H12O5 |
| InChI |
InChI=1S/C9H12O5/c1-12-6-4-5-7(8(10)13-2)9(11)14-3/h4-6H,1-3H3/b6-4+ |
| InChIKey |
NOBNTZJTOBIOHL-GQCTYLIASA-N |
| Molecular Weight |
200.190 g/mol |
| SMILES |
C(C(C(OC)=O)=C\C=C\OC)(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.984565 |
