| SpectraBase Compound ID | FILR0uK9EQx |
|---|---|
| InChI | InChI=1S/C20H38O/c1-3-5-7-9-11-12-14-16-18-20(19-21)17-15-13-10-8-6-4-2/h18-19H,3-17H2,1-2H3/b20-18+ |
| InChIKey | WLUZPPJJEOWTBI-CZIZESTLSA-N |
| Mol Weight | 294.5 g/mol |
| Molecular Formula | C20H38O |
| Exact Mass | 294.292266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AzlJF9wNGGZ |
|---|---|
| Name | (E)-2-Octyl-2-dodecenal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.292265843 u |
| Formula | C20H38O |
| InChI | InChI=1S/C20H38O/c1-3-5-7-9-11-12-14-16-18-20(19-21)17-15-13-10-8-6-4-2/h18-19H,3-17H2,1-2H3/b20-18+ |
| InChIKey | WLUZPPJJEOWTBI-CZIZESTLSA-N |
| SMILES | C(\C=C\(C=O)CCCCCCCC)CCCCCCCC |