| SpectraBase Compound ID | JCbhBad964u |
|---|---|
| InChI | InChI=1S/C19H32O3/c1-18(20)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19(21)22-2/h3-4,8,10H,5-7,9,11-17H2,1-2H3/b4-3-,10-8- |
| InChIKey | GRDDGHNKPSSLBI-YHOGECKDSA-N |
| Mol Weight | 308.5 g/mol |
| Molecular Formula | C19H32O3 |
| Exact Mass | 308.235145 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BuGF3VBOCbT |
|---|---|
| Name | 17-Oxolinoleic acid, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.235144887 u |
| Formula | C19H32O3 |
| InChI | InChI=1S/C19H32O3/c1-18(20)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19(21)22-2/h3-4,8,10H,5-7,9,11-17H2,1-2H3/b4-3-,10-8- |
| InChIKey | GRDDGHNKPSSLBI-YHOGECKDSA-N |
| Molecular Weight | 308.462 g/mol |
| SMILES | C(=O)(OC)CCCCCCC\C=C/C\C=C/CCCC(=O)C |