| SpectraBase Compound ID | EL0xoEldhz4 |
|---|---|
| InChI | InChI=1S/C14H18O2/c1-10(15)11-5-7-12(8-6-11)13-3-2-4-14(16)9-13/h5-8,13-14,16H,2-4,9H2,1H3/t13-,14+/m0/s1 |
| InChIKey | DGMJTESFDAUACT-UONOGXRCSA-N |
| Mol Weight | 218.3 g/mol |
| Molecular Formula | C14H18O2 |
| Exact Mass | 218.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HgJIgB3aHyF |
|---|---|
| Name | (1R,3S)-3-(p-Acetylphenyl)cyclohexanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.130679818 u |
| Formula | C14H18O2 |
| InChI | InChI=1S/C14H18O2/c1-10(15)11-5-7-12(8-6-11)13-3-2-4-14(16)9-13/h5-8,13-14,16H,2-4,9H2,1H3/t13-,14+/m0/s1 |
| InChIKey | DGMJTESFDAUACT-UONOGXRCSA-N |
| Molecular Weight | 218.296 g/mol |
| SMILES | [C@]1(C=2C=CC(=CC2)C(=O)C)(C[C@](O)(CCC1)[H])[H] |