| SpectraBase Compound ID | HOFDF8pZe8f |
|---|---|
| InChI | InChI=1S/C20H34O4/c1-17(2)13-15-23-19(21)11-9-7-5-6-8-10-12-20(22)24-16-14-18(3)4/h13-14H,5-12,15-16H2,1-4H3 |
| InChIKey | SBTCSFVKCOKYIX-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 | KTkTAm0Hd1n |
|---|---|
| Name | Sebacic acid, di(3-methylbut-2-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/c1-17(2)13-15-23-19(21)11-9-7-5-6-8-10-12-20(22)24-16-14-18(3)4/h13-14H,5-12,15-16H2,1-4H3 |
| InChIKey | SBTCSFVKCOKYIX-UHFFFAOYSA-N |
| Molecular Weight | 338.488 g/mol |
| SMILES | C(CCCCCCCCC(OCC=C(C)C)=O)(OCC=C(C)C)=O |