| SpectraBase Compound ID | 4Tth6fPGqo |
|---|---|
| InChI | InChI=1S/C14H16O2/c1-11(15)16-14-9-5-8-13(10-14)12-6-3-2-4-7-12/h2-4,6-7,10,14H,5,8-9H2,1H3 |
| InChIKey | FZESTGDBSBBVQT-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 | k0kZXhVNPf |
|---|---|
| Name | 3-Phenylcyclohex-2-enyl acetate |
| 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/c1-11(15)16-14-9-5-8-13(10-14)12-6-3-2-4-7-12/h2-4,6-7,10,14H,5,8-9H2,1H3 |
| InChIKey | FZESTGDBSBBVQT-UHFFFAOYSA-N |
| Molecular Weight | 216.280 g/mol |
| SMILES | C1(C=C(CCC1)C1=CC=CC=C1)OC(C)=O |