| SpectraBase Compound ID | Dp0qo8mBB79 |
|---|---|
| InChI | InChI=1S/C19H36O2/c1-3-5-7-9-11-12-13-15-17-19(20)21-18-16-14-10-8-6-4-2/h3H,1,4-18H2,2H3 |
| InChIKey | PKLGTKSKHJFCIX-UHFFFAOYSA-N |
| Mol Weight | 296.5 g/mol |
| Molecular Formula | C19H36O2 |
| Exact Mass | 296.27153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5GUY1wVOuJH |
|---|---|
| Name | 10-Undecenoic acid, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.271530397 u |
| Formula | C19H36O2 |
| InChI | InChI=1S/C19H36O2/c1-3-5-7-9-11-12-13-15-17-19(20)21-18-16-14-10-8-6-4-2/h3H,1,4-18H2,2H3 |
| InChIKey | PKLGTKSKHJFCIX-UHFFFAOYSA-N |
| SMILES | C(C(OCCCCCCCC)=O)CCCCCCCC=C |