| SpectraBase Compound ID | 90q1diMZA5m |
|---|---|
| InChI | InChI=1S/C20H22O/c21-20(19-15-9-5-10-16-19)17-11-3-1-2-6-12-18-13-7-4-8-14-18/h4-5,7-11,13-17H,1-3,6,12H2/b17-11+ |
| InChIKey | BIERJGJHHRQWNK-GZTJUZNOSA-N |
| Mol Weight | 278.39 g/mol |
| Molecular Formula | C20H22O |
| Exact Mass | 278.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G0o4TxKrpuI |
|---|---|
| Name | 1,8-Diphenyloct-2-en-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.167065327 u |
| Formula | C20H22O |
| InChI | InChI=1S/C20H22O/c21-20(19-15-9-5-10-16-19)17-11-3-1-2-6-12-18-13-7-4-8-14-18/h4-5,7-11,13-17H,1-3,6,12H2/b17-11+ |
| InChIKey | BIERJGJHHRQWNK-GZTJUZNOSA-N |
| SMILES | C(\C=C\CCCCCC=1C=CC=CC1)(=O)C=1C=CC=CC1 |