![1,2-Di[(1'-hydroxycyclohexyl)methyl]benzene](/api/spectrum/V5WJ8eIANA/structure.png?h=300&w=458 "1,2-Di[(1'-hydroxycyclohexyl)methyl]benzene")
| SpectraBase Compound ID | LLnAHA962hc |
|---|---|
| InChI | InChI=1S/C20H30O2/c21-19(11-5-1-6-12-19)15-17-9-3-4-10-18(17)16-20(22)13-7-2-8-14-20/h3-4,9-10,21-22H,1-2,5-8,11-16H2 |
| InChIKey | QYNXCYMVMPSBEH-UHFFFAOYSA-N |
| Mol Weight | 302.46 g/mol |
| Molecular Formula | C20H30O2 |
| Exact Mass | 302.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | V5WJ8eIANA |
|---|---|
| Name | 1,2-di[(1'-Hydroxycyclohexyl)methyl]benzene |
| 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/c21-19(11-5-1-6-12-19)15-17-9-3-4-10-18(17)16-20(22)13-7-2-8-14-20/h3-4,9-10,21-22H,1-2,5-8,11-16H2 |
| InChIKey | QYNXCYMVMPSBEH-UHFFFAOYSA-N |
| SMILES | C=1(C(CC2(O)CCCCC2)=CC=CC1)CC1(O)CCCCC1 |