| SpectraBase Compound ID | 6KXQ0AdLAAX |
|---|---|
| InChI | InChI=1S/C5H6O4/c1-9-5(8)3-2-4(6)7/h2-3H,1H3,(H,6,7)/b3-2+ |
| InChIKey | NKHAVTQWNUWKEO-NSCUHMNNSA-N |
| Mol Weight | 130.1 g/mol |
| Molecular Formula | C5H6O4 |
| Exact Mass | 130.026609 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GqsapbbHERl |
|---|---|
| Name | Monomethyl fumarate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H6O4 |
| InChI | InChI=1S/C5H6O4/c1-9-5(8)3-2-4(6)7/h2-3H,1H3,(H,6,7)/b3-2+ |
| InChIKey | NKHAVTQWNUWKEO-NSCUHMNNSA-N |
| Molecular Weight | 130.099 g/mol |
| SMILES | OC(\C=C\C(=O)OC)=O |
| SPLASH | splash10-0002-9000000000-ff22c6ef46913072e210 |
| Source of Spectrum | JF-331-1001-4 |
| Synonyms | (E)-4-methoxy-4-oxobut-2-enoic acid |
| Wiley ID | 1791775 |