| SpectraBase Compound ID | 3CUlLhal6f0 |
|---|---|
| InChI | InChI=1S/C17H34O2/c1-3-5-7-9-10-12-14-16-19-17(18)15-13-11-8-6-4-2/h3-16H2,1-2H3 |
| InChIKey | HSGQXSBXGSRINJ-UHFFFAOYSA-N |
| Mol Weight | 270.5 g/mol |
| Molecular Formula | C17H34O2 |
| Exact Mass | 270.25588 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DIrlfGb3wj8 |
|---|---|
| Name | Octanoic acid, nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.255880333 u |
| Formula | C17H34O2 |
| InChI | InChI=1S/C17H34O2/c1-3-5-7-9-10-12-14-16-19-17(18)15-13-11-8-6-4-2/h3-16H2,1-2H3 |
| InChIKey | HSGQXSBXGSRINJ-UHFFFAOYSA-N |
| Molecular Weight | 270.457 g/mol |
| SMILES | CCCCCCCC(OCCCCCCCCC)=O |