| SpectraBase Compound ID | 5ZwgjOlc4AF |
|---|---|
| InChI | InChI=1S/C21H34O/c1-18(2,3)17-11-9-16(10-12-17)15-21(22)19(4,5)13-8-14-20(21,6)7/h9-12,22H,8,13-15H2,1-7H3 |
| InChIKey | BLYGMZLGBXLUJP-UHFFFAOYSA-N |
| Mol Weight | 302.5 g/mol |
| Molecular Formula | C21H34O |
| Exact Mass | 302.260966 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 | 2nMEYfM8Wvl |
|---|---|
| Name | 1-(4-Tert-butyl)benzyl-2,2,6,6-tetramethyl-1-cyclohexanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.260965714 u |
| Formula | C21H34O |
| InChI | InChI=1S/C21H34O/c1-18(2,3)17-11-9-16(10-12-17)15-21(22)19(4,5)13-8-14-20(21,6)7/h9-12,22H,8,13-15H2,1-7H3 |
| InChIKey | BLYGMZLGBXLUJP-UHFFFAOYSA-N |
| SMILES | C1(C(CCCC1(C)C)(C)C)(CC1=CC=C(C(C)(C)C)C=C1)O |