| SpectraBase Compound ID | 8W2Y97wVGvs |
|---|---|
| InChI | InChI=1S/C23H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-26-22(24)16-17-23(25)27-20-18-21(2)3/h16-17H,2,4-15,18-20H2,1,3H3/b17-16+ |
| InChIKey | FIFVNNFPYNBJNY-WUKNDPDISA-N |
| Mol Weight | 380.6 g/mol |
| Molecular Formula | C23H40O4 |
| Exact Mass | 380.29266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Io4S4iggs7p |
|---|---|
| Name | Fumaric acid, 3-methylbut-3-enyl tetradecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 380.292659764 u |
| Formula | C23H40O4 |
| InChI | InChI=1S/C23H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-26-22(24)16-17-23(25)27-20-18-21(2)3/h16-17H,2,4-15,18-20H2,1,3H3/b17-16+ |
| InChIKey | FIFVNNFPYNBJNY-WUKNDPDISA-N |
| Molecular Weight | 380.569 g/mol |
| SMILES | CC(=C)CCOC(\C=C\C(OCCCCCCCCCCCCCC)=O)=O |