| SpectraBase Compound ID | 1i2fWKozARH |
|---|---|
| InChI | InChI=1S/C20H30O2/c1-3-5-7-17-8-12-18(13-9-17)20(21)22-19-14-10-16(6-4-2)11-15-19/h10-11,14-15,17-18H,3-9,12-13H2,1-2H3 |
| InChIKey | ZMYWQRQTUKPLRA-UHFFFAOYSA-N |
| Mol Weight | 302.46 g/mol |
| Molecular Formula | C20H30O2 |
| Exact Mass | 302.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6DrLFnV4W8A |
|---|---|
| Name | Cyclohexanecarboxylic acid, 4-butyl-, 4-propylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.224580204 u |
| Formula | C20H30O2 |
| InChI | InChI=1S/C20H30O2/c1-3-5-7-17-8-12-18(13-9-17)20(21)22-19-14-10-16(6-4-2)11-15-19/h10-11,14-15,17-18H,3-9,12-13H2,1-2H3 |
| InChIKey | ZMYWQRQTUKPLRA-UHFFFAOYSA-N |
| SMILES | C1C(CCC(C1)CCCC)C(=O)OC=1C=CC(=CC1)CCC |