| SpectraBase Compound ID | x1ADRWn98g |
|---|---|
| InChI | InChI=1S/C13H19NO2/c1-2-3-4-5-8-11-16-13(15)12-9-6-7-10-14-12/h6-7,9-10H,2-5,8,11H2,1H3 |
| InChIKey | TTYLHMSALCBTCD-UHFFFAOYSA-N |
| Mol Weight | 221.3 g/mol |
| Molecular Formula | C13H19NO2 |
| Exact Mass | 221.141579 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LWozzmxahUm |
|---|---|
| Name | 2-Pyridinecarboxylic acid, heptyl ester |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H19NO2 |
| InChI | InChI=1S/C13H19NO2/c1-2-3-4-5-8-11-16-13(15)12-9-6-7-10-14-12/h6-7,9-10H,2-5,8,11H2,1H3 |
| InChIKey | TTYLHMSALCBTCD-UHFFFAOYSA-N |
| Molecular Weight | 221.300 g/mol |
| SMILES | c1cc(ncc1)C(=O)OCCCCCCC |
| SPLASH | splash10-05di-9800000000-89e3ac1d899e7afc6b82 |
| Source of Spectrum | TIPS-2023-1046-0 |
| Wiley ID | 1885752 |