| SpectraBase Compound ID | LQxSpLsSucD |
|---|---|
| InChI | InChI=1S/C15H23NO2/c1-2-3-4-5-6-7-10-15(17)18-13-14-9-8-11-16-12-14/h8-9,11-12H,2-7,10,13H2,1H3 |
| InChIKey | JGUBTEHTHZTOAW-UHFFFAOYSA-N |
| Mol Weight | 249.35 g/mol |
| Molecular Formula | C15H23NO2 |
| Exact Mass | 249.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5jQhWBatZnf |
|---|---|
| Name | Nonanoic acid, picolinyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.172878983 u |
| Formula | C15H23NO2 |
| InChI | InChI=1S/C15H23NO2/c1-2-3-4-5-6-7-10-15(17)18-13-14-9-8-11-16-12-14/h8-9,11-12H,2-7,10,13H2,1H3 |
| InChIKey | JGUBTEHTHZTOAW-UHFFFAOYSA-N |
| Molecular Weight | 249.354 g/mol |
| SMILES | C1(=CN=CC=C1)COC(CCCCCCCC)=O |