| SpectraBase Compound ID | Wfuhe0UsvS |
|---|---|
| InChI | InChI=1S/C7H10O4/c1-3-11-6(8)4-5(2)7(9)10/h2-4H2,1H3,(H,9,10) |
| InChIKey | RTTAGBVNSDJDTE-UHFFFAOYSA-N |
| Mol Weight | 158.15 g/mol |
| Molecular Formula | C7H10O4 |
| Exact Mass | 158.057909 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 9jw6Qh5Pe5I |
|---|---|
| Name | Methylenesuccinic acid, 4-ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.057908798 u |
| Formula | C7H10O4 |
| InChI | InChI=1S/C7H10O4/c1-3-11-6(8)4-5(2)7(9)10/h2-4H2,1H3,(H,9,10) |
| InChIKey | RTTAGBVNSDJDTE-UHFFFAOYSA-N |
| SMILES | C=C(C(=O)O)CC(=O)OCC |
| Spectrum/Structure Validation Score (Raman) | 0.973402 |