| SpectraBase Compound ID | FbGg4NhnVBZ |
|---|---|
| InChI | InChI=1S/C18H16O/c19-18-13-16(14-7-3-1-4-8-14)11-12-17(18)15-9-5-2-6-10-15/h1-10,12,16H,11,13H2 |
| InChIKey | CCTLWQCNDJPZHU-UHFFFAOYSA-N |
| Mol Weight | 248.32 g/mol |
| Molecular Formula | C18H16O |
| Exact Mass | 248.120115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BzDkCx3cJhF |
|---|---|
| Name | 2,5-Diphenyl-2-cyclohexen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.120115134 u |
| Formula | C18H16O |
| InChI | InChI=1S/C18H16O/c19-18-13-16(14-7-3-1-4-8-14)11-12-17(18)15-9-5-2-6-10-15/h1-10,12,16H,11,13H2 |
| InChIKey | CCTLWQCNDJPZHU-UHFFFAOYSA-N |
| Molecular Weight | 248.325 g/mol |
| SMILES | C1=CC=C(C=2C(CC(C3=CC=CC=C3)CC2)=O)C=C1 |