| SpectraBase Compound ID | KKSoyKzpQ1i |
|---|---|
| InChI | InChI=1S/C20H29NO2/c1-2-3-4-5-6-7-8-9-10-11-12-15-20(22)23-18-19-14-13-16-21-17-19/h3,13-14,16-17H,1,4-12,15,18H2 |
| InChIKey | QHMLSHSDFHJNDJ-UHFFFAOYSA-N |
| Mol Weight | 315.46 g/mol |
| Molecular Formula | C20H29NO2 |
| Exact Mass | 315.219829 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A6aFQ6if8F8 |
|---|---|
| Name | Picolinyl 12,13-tetradecadienoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.219829176 u |
| Formula | C20H29NO2 |
| InChI | InChI=1S/C20H29NO2/c1-2-3-4-5-6-7-8-9-10-11-12-15-20(22)23-18-19-14-13-16-21-17-19/h3,13-14,16-17H,1,4-12,15,18H2 |
| InChIKey | QHMLSHSDFHJNDJ-UHFFFAOYSA-N |
| Molecular Weight | 315.457 g/mol |
| SMILES | C(CC(=O)OCC1=CC=CN=C1)CCCCCCCCC=C=C |