| SpectraBase Compound ID | KHGfmFrQTMu |
|---|---|
| InChI | InChI=1S/C14H21NO2/c1-2-3-4-5-6-9-12-17-14(16)13-10-7-8-11-15-13/h7-8,10-11H,2-6,9,12H2,1H3 |
| InChIKey | HYHXTSDISHWRAY-UHFFFAOYSA-N |
| Mol Weight | 235.33 g/mol |
| Molecular Formula | C14H21NO2 |
| Exact Mass | 235.157229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GlRQqOYJvCM |
|---|---|
| Name | Picolinic acid, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.157228918 u |
| Formula | C14H21NO2 |
| InChI | InChI=1S/C14H21NO2/c1-2-3-4-5-6-9-12-17-14(16)13-10-7-8-11-15-13/h7-8,10-11H,2-6,9,12H2,1H3 |
| InChIKey | HYHXTSDISHWRAY-UHFFFAOYSA-N |
| Molecular Weight | 235.327 g/mol |
| SMILES | C1=NC(=CC=C1)C(OCCCCCCCC)=O |