| SpectraBase Compound ID | 8C6mJ28kW2O |
|---|---|
| InChI | InChI=1S/C16H14O2/c17-13-5-1-3-7-15-9-11-16(12-10-15)8-4-2-6-14-18/h1-14H/b5-1+,6-2+,7-3+,8-4+ |
| InChIKey | UWPFWOSZLPXGSC-VYUKIJHXSA-N |
| Mol Weight | 238.29 g/mol |
| Molecular Formula | C16H14O2 |
| Exact Mass | 238.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1KoNsxAxHeX |
|---|---|
| Name | (1,4-Phenylene)-5,5-bis(penta-dien-1-al) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.099379689 u |
| Formula | C16H14O2 |
| InChI | InChI=1S/C16H14O2/c17-13-5-1-3-7-15-9-11-16(12-10-15)8-4-2-6-14-18/h1-14H/b5-1+,6-2+,7-3+,8-4+ |
| InChIKey | UWPFWOSZLPXGSC-VYUKIJHXSA-N |
| Molecular Weight | 238.286 g/mol |
| SMILES | C=1(\C=C\C=C\C=O)C=CC(\C=C\C=C\C=O)=CC1 |