| SpectraBase Compound ID | In16hIx51A7 |
|---|---|
| InChI | InChI=1S/C24H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h2,17-18,20-21H,1,3,6-16,19,22H2 |
| InChIKey | YFBWMYGRKRJZJC-UHFFFAOYSA-N |
| Mol Weight | 369.5 g/mol |
| Molecular Formula | C24H35NO2 |
| Exact Mass | 369.266779 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FWtc8EBArlC |
|---|---|
| Name | Picolinyl octadeca-14-yn-17-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 369.266779369 u |
| Formula | C24H35NO2 |
| InChI | InChI=1S/C24H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h2,17-18,20-21H,1,3,6-16,19,22H2 |
| InChIKey | YFBWMYGRKRJZJC-UHFFFAOYSA-N |
| Molecular Weight | 369.549 g/mol |
| SMILES | C1=CN=CC(=C1)COC(CCCCCCCCCCCCC#CCC=C)=O |