| SpectraBase Compound ID | DdVGSfKXb1N |
|---|---|
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-6,11,14H,7-9H2,1-4H3 |
| InChIKey | WPGXAVCJKGSOBD-UHFFFAOYSA-N |
| Mol Weight | 194.32 g/mol |
| Molecular Formula | C13H22O |
| Exact Mass | 194.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2LRr88zZ2J5 |
|---|---|
| Name | 4-(2,6,6-Trimethyl-1-cyclohexa-1,3-dienyl)-2-butanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.167065327 u |
| Formula | C13H22O |
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-6,11,14H,7-9H2,1-4H3 |
| InChIKey | WPGXAVCJKGSOBD-UHFFFAOYSA-N |
| Molecular Weight | 194.318 g/mol |
| SMILES | C1(=C(C=CCC1(C)C)C)CCC(O)C |