![2-Hexylbicyclo[2.2.2]octane](/api/spectrum/DFVKOsxswvX/structure.png?h=300&w=458 "2-Hexylbicyclo[2.2.2]octane")
| SpectraBase Compound ID | KOUWIZ6ZJR3 |
|---|---|
| InChI | InChI=1S/C14H26/c1-2-3-4-5-6-14-11-12-7-9-13(14)10-8-12/h12-14H,2-11H2,1H3/t12-,13+,14-/m0/s1 |
| InChIKey | HNOYRLKCFRKUDP-MJBXVCDLSA-N |
| Mol Weight | 194.36 g/mol |
| Molecular Formula | C14H26 |
| Exact Mass | 194.203451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DFVKOsxswvX |
|---|---|
| Name | 2-Hexylbicyclo[2.2.2]octane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.203450837 u |
| Formula | C14H26 |
| InChI | InChI=1S/C14H26/c1-2-3-4-5-6-14-11-12-7-9-13(14)10-8-12/h12-14H,2-11H2,1H3/t12-,13+,14-/m0/s1 |
| InChIKey | HNOYRLKCFRKUDP-MJBXVCDLSA-N |
| Molecular Weight | 194.362 g/mol |
| SMILES | [C@]12(CC[C@]([C@](C2)(CCCCCC)[H])(CC1)[H])[H] |