| SpectraBase Compound ID | FGblKNk4Ek3 |
|---|---|
| InChI | InChI=1S/C26H48O4/c1-3-5-7-8-9-10-11-14-17-20-24-30-26(28)22-19-16-13-12-15-18-21-25(27)29-23-6-4-2/h4H,2-3,5-24H2,1H3 |
| InChIKey | TWAMPNVGXDKUBN-UHFFFAOYSA-N |
| Mol Weight | 424.7 g/mol |
| Molecular Formula | C26H48O4 |
| Exact Mass | 424.35526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GBmrN0EMg8j |
|---|---|
| Name | Sebacic acid, but-3-enyl dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 424.355260022 u |
| Formula | C26H48O4 |
| InChI | InChI=1S/C26H48O4/c1-3-5-7-8-9-10-11-14-17-20-24-30-26(28)22-19-16-13-12-15-18-21-25(27)29-23-6-4-2/h4H,2-3,5-24H2,1H3 |
| InChIKey | TWAMPNVGXDKUBN-UHFFFAOYSA-N |
| Molecular Weight | 424.666 g/mol |
| SMILES | C(CCOC(CCCCCCCCC(OCCCCCCCCCCCC)=O)=O)=C |