| SpectraBase Compound ID | FFESbK6C6QE |
|---|---|
| InChI | InChI=1S/C17H28O4/c1-3-5-6-7-8-9-10-11-12-15-21-17(19)14-13-16(18)20-4-2/h11-14H,3-10,15H2,1-2H3/b12-11+,14-13+ |
| InChIKey | PPFZVPVYDQAWDX-LDHFCIDVSA-N |
| Mol Weight | 296.41 g/mol |
| Molecular Formula | C17H28O4 |
| Exact Mass | 296.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JJIdqzu6zhq |
|---|---|
| Name | Fumaric acid, ethyl undec-2-en-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.198759378 u |
| Formula | C17H28O4 |
| InChI | InChI=1S/C17H28O4/c1-3-5-6-7-8-9-10-11-12-15-21-17(19)14-13-16(18)20-4-2/h11-14H,3-10,15H2,1-2H3/b12-11+,14-13+ |
| InChIKey | PPFZVPVYDQAWDX-LDHFCIDVSA-N |
| Molecular Weight | 296.407 g/mol |
| SMILES | CCCCCCCC\C=C\COC(\C=C\C(OCC)=O)=O |