| SpectraBase Compound ID | LEkgsBxYrOz |
|---|---|
| InChI | InChI=1S/C20H34O4/c1-3-5-13-17-23-19(21)15-11-9-7-8-10-12-16-20(22)24-18-14-6-4-2/h3-4H,1-2,5-18H2 |
| InChIKey | ZZKXHYGNRATKKE-UHFFFAOYSA-N |
| Mol Weight | 338.5 g/mol |
| Molecular Formula | C20H34O4 |
| Exact Mass | 338.24571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4aZqDgmH1Nq |
|---|---|
| Name | Sebacic acid, di(pent-4-enyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.245709571 u |
| Formula | C20H34O4 |
| InChI | InChI=1S/C20H34O4/c1-3-5-13-17-23-19(21)15-11-9-7-8-10-12-16-20(22)24-18-14-6-4-2/h3-4H,1-2,5-18H2 |
| InChIKey | ZZKXHYGNRATKKE-UHFFFAOYSA-N |
| Molecular Weight | 338.488 g/mol |
| SMILES | C(CCCCCC(OCCCC=C)=O)CCC(OCCCC=C)=O |