| SpectraBase Spectrum ID |
AHFwqOCbJFi |
| Name |
(E)-2-(1-Methoxyethyl)-2-butenedioic acid dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
202.084123546 u |
| Formula |
C9H14O5 |
| InChI |
InChI=1S/C9H14O5/c1-6(12-2)7(9(11)14-4)5-8(10)13-3/h5-6H,1-4H3/b7-5+ |
| InChIKey |
WVWRHFSVHXJBTA-FNORWQNLSA-N |
| Molecular Weight |
202.206 g/mol |
| SMILES |
C(\C=C\(C(=O)OC)C(OC)C)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.987499 |
