| SpectraBase Compound ID | 4X8wCd4hmMD |
|---|---|
| InChI | InChI=1S/C17H25NO2/c1-2-3-4-5-6-7-8-9-12-17(19)20-15-16-11-10-13-18-14-16/h2,10-11,13-14H,1,3-9,12,15H2 |
| InChIKey | BGLYRRAMMMXUMK-UHFFFAOYSA-N |
| Mol Weight | 275.39 g/mol |
| Molecular Formula | C17H25NO2 |
| Exact Mass | 275.188529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 32f6Xqy5em |
|---|---|
| Name | 10-Undecenoic acid, picolinyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.188529047 u |
| Formula | C17H25NO2 |
| InChI | InChI=1S/C17H25NO2/c1-2-3-4-5-6-7-8-9-12-17(19)20-15-16-11-10-13-18-14-16/h2,10-11,13-14H,1,3-9,12,15H2 |
| InChIKey | BGLYRRAMMMXUMK-UHFFFAOYSA-N |
| Molecular Weight | 275.392 g/mol |
| SMILES | C(=O)(OCC1=CN=CC=C1)CCCCCCCCC=C |