| SpectraBase Compound ID | EOMYpeo0u23 |
|---|---|
| InChI | InChI=1S/C12H22O2/c1-11(2,14)8-9-12(3)6-4-10(13)5-7-12/h4,6,10,13-14H,5,7-9H2,1-3H3 |
| InChIKey | UKVHEVCCFNATKS-UHFFFAOYSA-N |
| Mol Weight | 198.31 g/mol |
| Molecular Formula | C12H22O2 |
| Exact Mass | 198.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4emZ7zjtOPa |
|---|---|
| Name | 4-Methyl 4-(3-hydroxy-3-methylbutanyl)-2-cyclohexenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.161979946 u |
| Formula | C12H22O2 |
| InChI | InChI=1S/C12H22O2/c1-11(2,14)8-9-12(3)6-4-10(13)5-7-12/h4,6,10,13-14H,5,7-9H2,1-3H3 |
| InChIKey | UKVHEVCCFNATKS-UHFFFAOYSA-N |
| Molecular Weight | 198.306 g/mol |
| SMILES | C1(C=CC(CC1)(CCC(C)(C)O)C)O |