| SpectraBase Compound ID | DpQR2rFQDja |
|---|---|
| InChI | InChI=1S/C14H20O4/c1-3-5-7-11-17-13(15)9-10-14(16)18-12-8-6-4-2/h3-4,9-10H,1-2,5-8,11-12H2/b10-9+ |
| InChIKey | AUCLTYLEVXSTDN-MDZDMXLPSA-N |
| Mol Weight | 252.31 g/mol |
| Molecular Formula | C14H20O4 |
| Exact Mass | 252.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ki3cwFUTULI |
|---|---|
| Name | Fumaric acid, di(pent-4-enyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.136159120 u |
| Formula | C14H20O4 |
| InChI | InChI=1S/C14H20O4/c1-3-5-7-11-17-13(15)9-10-14(16)18-12-8-6-4-2/h3-4,9-10H,1-2,5-8,11-12H2/b10-9+ |
| InChIKey | AUCLTYLEVXSTDN-MDZDMXLPSA-N |
| Molecular Weight | 252.310 g/mol |
| SMILES | C(\C=C\C(OCCCC=C)=O)(OCCCC=C)=O |