| SpectraBase Compound ID | zmhrTSDrl |
|---|---|
| InChI | InChI=1S/C14H18O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11H2 |
| InChIKey | MWAICOLEKXKHAY-UHFFFAOYSA-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 | FCmAb2H4UIb |
|---|---|
| Name | Cyclohexanecarboxylic acid, phenylmethyl ester |
| 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/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11H2 |
| InChIKey | MWAICOLEKXKHAY-UHFFFAOYSA-N |
| Molecular Weight | 218.296 g/mol |
| SMILES | C1=CC=CC=C1COC(=O)C1CCCCC1 |