| SpectraBase Compound ID | 5KM7u7ILzNa |
|---|---|
| InChI | InChI=1S/C8H18O/c1-5-6(2)7(3)8(4)9/h6-9H,5H2,1-4H3 |
| InChIKey | LBJWJHMCZHKLQU-UHFFFAOYSA-N |
| Mol Weight | 130.23 g/mol |
| Molecular Formula | C8H18O |
| Exact Mass | 130.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LKS8WRlmUkV |
|---|---|
| Name | 3,4-Dimethyl-2-hexanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 130.135765199 u |
| Formula | C8H18O |
| InChI | InChI=1S/C8H18O/c1-5-6(2)7(3)8(4)9/h6-9H,5H2,1-4H3 |
| InChIKey | LBJWJHMCZHKLQU-UHFFFAOYSA-N |
| Molecular Weight | 130.231 g/mol |
| SMILES | OC(C(C(CC)C)C)C |