| SpectraBase Compound ID | zzXSHhorJU |
|---|---|
| InChI | InChI=1S/C19H16O3/c20-16-12-7-13-17(18(16)14-8-3-1-4-9-14)22-19(21)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2 |
| InChIKey | FRDJUWXAJKWRLD-UHFFFAOYSA-N |
| Mol Weight | 292.33 g/mol |
| Molecular Formula | C19H16O3 |
| Exact Mass | 292.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BhukAM8VGqp |
|---|---|
| Name | 2-Cyclohexen-1-one, 3-(benzoyloxy)-2-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.109944372 u |
| Formula | C19H16O3 |
| InChI | InChI=1S/C19H16O3/c20-16-12-7-13-17(18(16)14-8-3-1-4-9-14)22-19(21)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2 |
| InChIKey | FRDJUWXAJKWRLD-UHFFFAOYSA-N |
| SMILES | C1(=C(C(=O)CCC1)C=1C=CC=CC1)OC(=O)C1=CC=CC=C1 |