| SpectraBase Compound ID | 9xh6PxpIeZ7 |
|---|---|
| InChI | InChI=1S/C16H28O/c1-15(2,17)4-3-5-16-9-12-6-13(10-16)8-14(7-12)11-16/h12-14,17H,3-11H2,1-2H3/t12-,13+,14-,16+ |
| InChIKey | RCJSEVKNFJYNNT-UWOLEIRVSA-N |
| Mol Weight | 236.4 g/mol |
| Molecular Formula | C16H28O |
| Exact Mass | 236.214016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7CEH49F07Ww |
|---|---|
| Name | 2-Methyl-5-(1-adamantyl)pentan-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(2,17)4-3-5-16-9-12-6-13(10-16)8-14(7-12)11-16/h12-14,17H,3-11H2,1-2H3/t12-,13+,14-,16+ |
| InChIKey | RCJSEVKNFJYNNT-UWOLEIRVSA-N |
| Molecular Weight | 236.399 g/mol |
| SMILES | C(O)(C)(C)CCCC12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H] |