| SpectraBase Compound ID | HpXC0AklGw9 |
|---|---|
| InChI | InChI=1S/C14H16O2/c1-10-6-8-11(9-7-10)14(16)12-4-2-3-5-13(12)15/h6-9,12H,2-5H2,1H3 |
| InChIKey | OADQEYNOCSVVRZ-UHFFFAOYSA-N |
| Mol Weight | 216.28 g/mol |
| Molecular Formula | C14H16O2 |
| Exact Mass | 216.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4qJWmN1Ir1i |
|---|---|
| Name | 2-(4-Methylbenzoyl)cyclohexan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.115029753 u |
| Formula | C14H16O2 |
| InChI | InChI=1S/C14H16O2/c1-10-6-8-11(9-7-10)14(16)12-4-2-3-5-13(12)15/h6-9,12H,2-5H2,1H3 |
| InChIKey | OADQEYNOCSVVRZ-UHFFFAOYSA-N |
| Molecular Weight | 216.280 g/mol |
| SMILES | C1(=CC=C(C=C1)C(C1CCCCC1=O)=O)C |