| SpectraBase Compound ID | EW7T4gxTKTg |
|---|---|
| InChI | InChI=1S/C24H45NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-24(26)25-22-19-16-17-20-23-25/h9-10H,2-8,11-23H2,1H3/b10-9+ |
| InChIKey | VADPGEGXKQJSBO-MDZDMXLPSA-N |
| Mol Weight | 363.6 g/mol |
| Molecular Formula | C24H45NO |
| Exact Mass | 363.350115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FnS41vr5xii |
|---|---|
| Name | 1H-Azepine, hexahydro-1-(1-oxo-9-octadecenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 363.350115072 u |
| Formula | C24H45NO |
| InChI | InChI=1S/C24H45NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-24(26)25-22-19-16-17-20-23-25/h9-10H,2-8,11-23H2,1H3/b10-9+ |
| InChIKey | VADPGEGXKQJSBO-MDZDMXLPSA-N |
| Molecular Weight | 363.630 g/mol |
| SMILES | C(CCCCCCC\C=C\CCCCCCCC)(=O)N1CCCCCC1 |