| SpectraBase Compound ID | Cp3PpsdBtyz |
|---|---|
| InChI | InChI=1S/C19H22O2/c1-14-4-8-17(9-5-14)19(21,13-12-16(3)20)18-10-6-15(2)7-11-18/h4-11,21H,12-13H2,1-3H3 |
| InChIKey | MVXQSOYVFQZUBW-UHFFFAOYSA-N |
| Mol Weight | 282.38 g/mol |
| Molecular Formula | C19H22O2 |
| Exact Mass | 282.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AFJ6Re3XHKN |
|---|---|
| Name | 5-Hydroxy-5,5-bis(4-methylphenyl)-2-pentanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.161979946 u |
| Formula | C19H22O2 |
| InChI | InChI=1S/C19H22O2/c1-14-4-8-17(9-5-14)19(21,13-12-16(3)20)18-10-6-15(2)7-11-18/h4-11,21H,12-13H2,1-3H3 |
| InChIKey | MVXQSOYVFQZUBW-UHFFFAOYSA-N |
| SMILES | C(CCC(=O)C)(C1=CC=C(C=C1)C)(C=1C=CC(=CC1)C)O |