| SpectraBase Compound ID | 7vkFLPRdcS0 |
|---|---|
| InChI | InChI=1S/C24H44O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28-23(25)18-19-24(26)29-22-21-27-2/h18-19H,3-17,20-22H2,1-2H3/b19-18+ |
| InChIKey | NHUMJRSOXBINCJ-VHEBQXMUSA-N |
| Mol Weight | 412.6 g/mol |
| Molecular Formula | C24H44O5 |
| Exact Mass | 412.318875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IKOvJu1cC33 |
|---|---|
| Name | Fumaric acid, heptadecyl 2-methoxyethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 412.318874512 u |
| Formula | C24H44O5 |
| InChI | InChI=1S/C24H44O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28-23(25)18-19-24(26)29-22-21-27-2/h18-19H,3-17,20-22H2,1-2H3/b19-18+ |
| InChIKey | NHUMJRSOXBINCJ-VHEBQXMUSA-N |
| Molecular Weight | 412.611 g/mol |
| SMILES | C(CCCOC(\C=C\C(OCCOC)=O)=O)CCCCCCCCCCCCC |