| SpectraBase Compound ID | FkkbB0mtX1m |
|---|---|
| InChI | InChI=1S/C14H18O3/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2,(H,15,16)/t12-,13+ |
| InChIKey | CIHKUOPEMAFMJE-BETUJISGSA-N |
| Mol Weight | 234.29 g/mol |
| Molecular Formula | C14H18O3 |
| Exact Mass | 234.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7QIPfOO8TkZ |
|---|---|
| Name | cis-4-(Benzyloxy)cyclohexanecarboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.125594437 u |
| Formula | C14H18O3 |
| InChI | InChI=1S/C14H18O3/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2,(H,15,16)/t12-,13+ |
| InChIKey | CIHKUOPEMAFMJE-BETUJISGSA-N |
| Molecular Weight | 234.295 g/mol |
| SMILES | C([C@]1(CC[C@@](OCC2=CC=CC=C2)(CC1)[H])[H])(=O)O |