| SpectraBase Compound ID | JJuF7ZVPf5i |
|---|---|
| InChI | InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+ |
| InChIKey | VZCYOOQTPOCHFL-OWOJBTEDSA-N |
| Mol Weight | 116.07 g/mol |
| Molecular Formula | C4H4O4 |
| Exact Mass | 116.010959 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DlHhm8aCwRk |
|---|---|
| Name | Fumaric acid |
| CAS Registry Number | 110-17-8 |
| Classification | Chemical |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 116.010958605 u |
| Formula | C4H4O4 |
| InChI | InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+ |
| InChIKey | VZCYOOQTPOCHFL-OWOJBTEDSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 116.072 g/mol |
| Nominal Mass | 116 u |
| Quality | 982 |
| Retention Index | 783 |
| SMILES | OC(\C=C\C(=O)O)=O |
| SPLASH | splash10-0002-9000000000-7d59c23ad90843fa367f |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | But-2-enedioic acid |
| Technique | GC/MS |
| Wiley ID | DD2024_024780 |