![Ethyl 2-[(1-hydroxy-2-isopropyl-5-methyl)cyclohexyl]hexaoate](/api/spectrum/9FICAJQqQR0/structure.png?h=300&w=458 "Ethyl 2-[(1-hydroxy-2-isopropyl-5-methyl)cyclohexyl]hexaoate")
| SpectraBase Compound ID | 5QMUJJZLCVS |
|---|---|
| InChI | InChI=1S/C18H34O3/c1-6-8-9-16(17(19)21-7-2)18(20)12-14(5)10-11-15(18)13(3)4/h13-16,20H,6-12H2,1-5H3 |
| InChIKey | GCCMBUUWEIGERV-UHFFFAOYSA-N |
| Mol Weight | 298.5 g/mol |
| Molecular Formula | C18H34O3 |
| Exact Mass | 298.250795 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9FICAJQqQR0 |
|---|---|
| Name | Ethyl 2-[(1-hydroxy-2-isopropyl-5-methyl)cyclohexyl]hexaoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.250794952 u |
| Formula | C18H34O3 |
| InChI | InChI=1S/C18H34O3/c1-6-8-9-16(17(19)21-7-2)18(20)12-14(5)10-11-15(18)13(3)4/h13-16,20H,6-12H2,1-5H3 |
| InChIKey | GCCMBUUWEIGERV-UHFFFAOYSA-N |
| SMILES | C1(C(C(=O)OCC)CCCC)(C(CCC(C1)C)C(C)C)O |