| SpectraBase Compound ID | 2QYiV5REWlL |
|---|---|
| InChI | InChI=1S/C24H37NO2/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/h17-18,20-21H,2-8,11-16,19,22H2,1H3 |
| InChIKey | HDYLLOMTZGULDB-UHFFFAOYSA-N |
| Mol Weight | 371.6 g/mol |
| Molecular Formula | C24H37NO2 |
| Exact Mass | 371.282429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Rthc9zH1g |
|---|---|
| Name | Picolinyl 9-octadecynoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 371.282429433 u |
| Formula | C24H37NO2 |
| InChI | InChI=1S/C24H37NO2/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/h17-18,20-21H,2-8,11-16,19,22H2,1H3 |
| InChIKey | HDYLLOMTZGULDB-UHFFFAOYSA-N |
| Molecular Weight | 371.565 g/mol |
| SMILES | C(CC(=O)OCC1=CC=CN=C1)CCCCCC#CCCCCCCCC |