| SpectraBase Compound ID | JS58ARwJ1iZ |
|---|---|
| InChI | InChI=1S/C16H28O/c1-15(2,3)4-5-16(17)13-7-11-6-12(9-13)10-14(16)8-11/h11-14,17H,4-10H2,1-3H3/t11-,12?,13-,14?,16-/m1/s1 |
| InChIKey | ORHPLIRYIUIXRZ-GORDNNNFSA-N |
| Mol Weight | 236.4 g/mol |
| Molecular Formula | C16H28O |
| Exact Mass | 236.214016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HZI8UG81fQS |
|---|---|
| Name | 2-(3,3-Dimethylbutyl)adamantan-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.214015521 u |
| Formula | C16H28O |
| InChI | InChI=1S/C16H28O/c1-15(2,3)4-5-16(17)13-7-11-6-12(9-13)10-14(16)8-11/h11-14,17H,4-10H2,1-3H3/t11-,12?,13-,14?,16-/m1/s1 |
| InChIKey | ORHPLIRYIUIXRZ-GORDNNNFSA-N |
| Molecular Weight | 236.399 g/mol |
| SMILES | [C@]1([C@@]2(C[C@@]3(CC1CC(C3)C2)[H])[H])(CCC(C)(C)C)O |