| SpectraBase Compound ID | DeRHVkwB19r |
|---|---|
| InChI | InChI=1S/C10H22O/c1-8(9(2)7-11)6-10(3,4)5/h8-9,11H,6-7H2,1-5H3 |
| InChIKey | BCTJQQUHPWYVBQ-UHFFFAOYSA-N |
| Mol Weight | 158.28 g/mol |
| Molecular Formula | C10H22O |
| Exact Mass | 158.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KCe5bKHZrp0 |
|---|---|
| Name | 1-Hexanol, 2,3,5,5-tetramethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.167065327 u |
| Formula | C10H22O |
| InChI | InChI=1S/C10H22O/c1-8(9(2)7-11)6-10(3,4)5/h8-9,11H,6-7H2,1-5H3 |
| InChIKey | BCTJQQUHPWYVBQ-UHFFFAOYSA-N |
| Molecular Weight | 158.285 g/mol |
| SMILES | OCC(C(CC(C)(C)C)C)C |