| SpectraBase Compound ID | 8MP7CmJ3KMU |
|---|---|
| InChI | InChI=1S/C24H42O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28-24(26)20-19-23(25)27-21-4-2/h4,19-20H,2-3,5-18,21-22H2,1H3/b20-19+ |
| InChIKey | WWCWFFJFDMNKHE-FMQUCBEESA-N |
| Mol Weight | 394.6 g/mol |
| Molecular Formula | C24H42O4 |
| Exact Mass | 394.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6mjyz4RVTBQ |
|---|---|
| Name | Fumaric acid, allyl heptadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 394.308309828 u |
| Formula | C24H42O4 |
| InChI | InChI=1S/C24H42O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28-24(26)20-19-23(25)27-21-4-2/h4,19-20H,2-3,5-18,21-22H2,1H3/b20-19+ |
| InChIKey | WWCWFFJFDMNKHE-FMQUCBEESA-N |
| Molecular Weight | 394.596 g/mol |
| SMILES | C(CCCCCCCCOC(\C=C\C(OCC=C)=O)=O)CCCCCCCC |