| SpectraBase Compound ID | KTXwWro0aJB |
|---|---|
| InChI | InChI=1S/C25H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-25(27)28-23-24-19-18-21-26-22-24/h11-12,18-19,21-22H,2-10,13-17,20,23H2,1H3/b12-11- |
| InChIKey | BAWLOAAROXGDOT-QXMHVHEDSA-N |
| Mol Weight | 387.6 g/mol |
| Molecular Formula | C25H41NO2 |
| Exact Mass | 387.31373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LnXwqOkzQNr |
|---|---|
| Name | Picolinyl 8-nonadecenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 387.313729562 u |
| Formula | C25H41NO2 |
| InChI | InChI=1S/C25H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-25(27)28-23-24-19-18-21-26-22-24/h11-12,18-19,21-22H,2-10,13-17,20,23H2,1H3/b12-11- |
| InChIKey | BAWLOAAROXGDOT-QXMHVHEDSA-N |
| Molecular Weight | 387.608 g/mol |
| SMILES | C(CC(=O)OCC1=CC=CN=C1)CCCC\C=C/CCCCCCCCCC |