| SpectraBase Compound ID | 958YhD3n6tu |
|---|---|
| InChI | InChI=1S/C16H22O/c17-16(15-11-5-2-6-12-15)13-7-10-14-8-3-1-4-9-14/h1,3-4,8-9,15H,2,5-7,10-13H2 |
| InChIKey | OOKIQFDXVMJTMM-UHFFFAOYSA-N |
| Mol Weight | 230.35 g/mol |
| Molecular Formula | C16H22O |
| Exact Mass | 230.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3RxkmydOTNv |
|---|---|
| Name | 1-Cyclohexyl-4-phenyl-1-butanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.167065327 u |
| Formula | C16H22O |
| InChI | InChI=1S/C16H22O/c17-16(15-11-5-2-6-12-15)13-7-10-14-8-3-1-4-9-14/h1,3-4,8-9,15H,2,5-7,10-13H2 |
| InChIKey | OOKIQFDXVMJTMM-UHFFFAOYSA-N |
| Molecular Weight | 230.351 g/mol |
| SMILES | C(=O)(C1CCCCC1)CCCC1=CC=CC=C1 |