| SpectraBase Compound ID | Enwm2BIXZvY |
|---|---|
| InChI | InChI=1S/C14H26O2/c1-2-3-4-7-12-16-14(15)11-10-13-8-5-6-9-13/h13H,2-12H2,1H3 |
| InChIKey | KGSNANUYCZAHJK-UHFFFAOYSA-N |
| Mol Weight | 226.36 g/mol |
| Molecular Formula | C14H26O2 |
| Exact Mass | 226.19328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8VkBHGkp7pv |
|---|---|
| Name | 3-Cyclopentylpropionic acid, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.193280075 u |
| Formula | C14H26O2 |
| InChI | InChI=1S/C14H26O2/c1-2-3-4-7-12-16-14(15)11-10-13-8-5-6-9-13/h13H,2-12H2,1H3 |
| InChIKey | KGSNANUYCZAHJK-UHFFFAOYSA-N |
| Molecular Weight | 226.360 g/mol |
| SMILES | C(=O)(OCCCCCC)CCC1CCCC1 |