| SpectraBase Compound ID | cr867ka9uz |
|---|---|
| InChI | InChI=1S/C15H28O2/c1-3-5-12-14(9-4-2)17-15(16)13-10-7-6-8-11-13/h13-14H,3-12H2,1-2H3 |
| InChIKey | OUEBAHHMKFOAAU-UHFFFAOYSA-N |
| Mol Weight | 240.39 g/mol |
| Molecular Formula | C15H28O2 |
| Exact Mass | 240.20893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ExAUavJublQ |
|---|---|
| Name | Cyclohexanecarboxylic acid, 4-octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.208930140 u |
| Formula | C15H28O2 |
| InChI | InChI=1S/C15H28O2/c1-3-5-12-14(9-4-2)17-15(16)13-10-7-6-8-11-13/h13-14H,3-12H2,1-2H3 |
| InChIKey | OUEBAHHMKFOAAU-UHFFFAOYSA-N |
| Molecular Weight | 240.387 g/mol |
| SMILES | CCCC(CCCC)OC(=O)C1CCCCC1 |