| SpectraBase Compound ID | F4tgOds6SyL |
|---|---|
| InChI | InChI=1S/C24H44O4/c1-5-7-9-11-13-15-17-21(3)27-23(25)19-20-24(26)28-22(4)18-16-14-12-10-8-6-2/h19-22H,5-18H2,1-4H3/b20-19+ |
| InChIKey | JTBIRPAFIJUFMV-FMQUCBEESA-N |
| Mol Weight | 396.6 g/mol |
| Molecular Formula | C24H44O4 |
| Exact Mass | 396.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 658wp3oZLQh |
|---|---|
| Name | Fumaric acid, di(2-decyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 396.323959893 u |
| Formula | C24H44O4 |
| InChI | InChI=1S/C24H44O4/c1-5-7-9-11-13-15-17-21(3)27-23(25)19-20-24(26)28-22(4)18-16-14-12-10-8-6-2/h19-22H,5-18H2,1-4H3/b20-19+ |
| InChIKey | JTBIRPAFIJUFMV-FMQUCBEESA-N |
| Molecular Weight | 396.612 g/mol |
| SMILES | C(OC(CCCCCCCC)C)(\C=C\C(OC(CCCCCCCC)C)=O)=O |