| SpectraBase Compound ID | 4fqMpVUCoor |
|---|---|
| InChI | InChI=1S/C21H22O2/c1-21(2,23)20(22)16-10-9-15-19(17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-15,23H,16H2,1-2H3/b10-9+ |
| InChIKey | BUCQEJNOFANLET-MDZDMXLPSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C21H22O2 |
| Exact Mass | 306.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 61LG56ieXHW |
|---|---|
| Name | 2-Hydroxy-2-methyl-8,8-diphenyl-octa-5,7-dien-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.161979946 u |
| Formula | C21H22O2 |
| InChI | InChI=1S/C21H22O2/c1-21(2,23)20(22)16-10-9-15-19(17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-15,23H,16H2,1-2H3/b10-9+ |
| InChIKey | BUCQEJNOFANLET-MDZDMXLPSA-N |
| Molecular Weight | 306.405 g/mol |
| SMILES | C1=CC(C(=C\C=C\CC(=O)C(C)(O)C)C2=CC=CC=C2)=CC=C1 |