| SpectraBase Compound ID | HErlPUjQrK7 |
|---|---|
| InChI | InChI=1S/C8H16O2/c1-5-3-8(10)6(2)4-7(5)9/h5-10H,3-4H2,1-2H3 |
| InChIKey | RRQDMZJIAHZBQM-UHFFFAOYSA-N |
| Mol Weight | 144.21 g/mol |
| Molecular Formula | C8H16O2 |
| Exact Mass | 144.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jl4zIIK6Stm |
|---|---|
| Name | 2,5-Dimethylcyclohexane-1,4-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.115029753 u |
| Formula | C8H16O2 |
| InChI | InChI=1S/C8H16O2/c1-5-3-8(10)6(2)4-7(5)9/h5-10H,3-4H2,1-2H3 |
| InChIKey | RRQDMZJIAHZBQM-UHFFFAOYSA-N |
| Molecular Weight | 144.214 g/mol |
| SMILES | C1(C(CC(C(C1)C)O)C)O |