| SpectraBase Compound ID | Ci9AJzq3PTr |
|---|---|
| InChI | InChI=1S/C18H30O4/c1-3-5-6-7-8-9-10-11-12-16-22-18(20)14-13-17(19)21-15-4-2/h4,13-14H,2-3,5-12,15-16H2,1H3/b14-13+ |
| InChIKey | ISQLFHKTOKELHW-BUHFOSPRSA-N |
| Mol Weight | 310.43 g/mol |
| Molecular Formula | C18H30O4 |
| Exact Mass | 310.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hqz2l3ORbP6 |
|---|---|
| Name | Fumaric acid, allyl undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.214409442 u |
| Formula | C18H30O4 |
| InChI | InChI=1S/C18H30O4/c1-3-5-6-7-8-9-10-11-12-16-22-18(20)14-13-17(19)21-15-4-2/h4,13-14H,2-3,5-12,15-16H2,1H3/b14-13+ |
| InChIKey | ISQLFHKTOKELHW-BUHFOSPRSA-N |
| SMILES | C(CCCCCCCCCOC(\C=C\C(OCC=C)=O)=O)C |