| SpectraBase Compound ID | IVpyOrgdMjg |
|---|---|
| InChI | InChI=1S/C14H16O3/c15-10-11-6-8-13(9-7-11)17-14(16)12-4-2-1-3-5-12/h6-10,12H,1-5H2 |
| InChIKey | CKBRDGXEMCBCOR-UHFFFAOYSA-N |
| Mol Weight | 232.28 g/mol |
| Molecular Formula | C14H16O3 |
| Exact Mass | 232.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FLVfiOUsZmS |
|---|---|
| Name | Cyclohexanecarboxylic acid, 4-formylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.109944372 u |
| Formula | C14H16O3 |
| InChI | InChI=1S/C14H16O3/c15-10-11-6-8-13(9-7-11)17-14(16)12-4-2-1-3-5-12/h6-10,12H,1-5H2 |
| InChIKey | CKBRDGXEMCBCOR-UHFFFAOYSA-N |
| Molecular Weight | 232.279 g/mol |
| SMILES | C1CCC(CC1)C(OC1=CC=C(C=C1)C=O)=O |