| SpectraBase Compound ID | k8T2J1a1b |
|---|---|
| InChI | InChI=1S/C14H14O2/c15-12-6-11-14(16)10-5-4-9-13-7-2-1-3-8-13/h1-5,7-10,12H,6,11H2/b9-4+,10-5+ |
| InChIKey | HVGZINLQIPWPRI-LUZURFALSA-N |
| Mol Weight | 214.26 g/mol |
| Molecular Formula | C14H14O2 |
| Exact Mass | 214.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HC3HuDIVudJ |
|---|---|
| Name | (E,E)-4-oxo-8-Phenyl-5,7-octadienal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.099379689 u |
| Formula | C14H14O2 |
| InChI | InChI=1S/C14H14O2/c15-12-6-11-14(16)10-5-4-9-13-7-2-1-3-8-13/h1-5,7-10,12H,6,11H2/b9-4+,10-5+ |
| InChIKey | HVGZINLQIPWPRI-LUZURFALSA-N |
| Molecular Weight | 214.264 g/mol |
| SMILES | C1(\C=C\C=C\C(=O)CCC=O)=CC=CC=C1 |