| SpectraBase Compound ID | 9cdouB0nfP5 |
|---|---|
| InChI | InChI=1S/C19H30O3/c1-2-21-19(20)16-12-7-5-3-4-6-8-13-17-22-18-14-10-9-11-15-18/h9-11,14-15H,2-8,12-13,16-17H2,1H3 |
| InChIKey | SBMNNAUBEFMXHP-UHFFFAOYSA-N |
| Mol Weight | 306.45 g/mol |
| Molecular Formula | C19H30O3 |
| Exact Mass | 306.219495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6j2LWsDzm56 |
|---|---|
| Name | 11-Phenoxyundecanoic acid, ethy L ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.219494823 u |
| Formula | C19H30O3 |
| InChI | InChI=1S/C19H30O3/c1-2-21-19(20)16-12-7-5-3-4-6-8-13-17-22-18-14-10-9-11-15-18/h9-11,14-15H,2-8,12-13,16-17H2,1H3 |
| InChIKey | SBMNNAUBEFMXHP-UHFFFAOYSA-N |
| SMILES | c1ccc(cc1)OCCCCCCCCCCC(=O)OCC |