![1-HEXANTHIOL, 6-(9-BORABICYCLO[3.3.1]NON-9-YLOXY)-](/api/spectrum/JnY0AaG90cq/structure.png?h=300&w=458 "1-HEXANTHIOL, 6-(9-BORABICYCLO[3.3.1]NON-9-YLOXY)-")
| SpectraBase Compound ID | 3YEfxHYr7c7 |
|---|---|
| InChI | InChI=1S/C14H27BOS/c17-12-4-2-1-3-11-16-15-13-7-5-8-14(15)10-6-9-13/h13-14,17H,1-12H2/t13-,14+ |
| InChIKey | MNROILAJDXVCTB-OKILXGFUSA-N |
| Mol Weight | 254.2 g/mol |
| Molecular Formula | C14H27BOS |
| Exact Mass | 254.187567 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JnY0AaG90cq |
|---|---|
| Name | 1-Hexanethiol, 6-(9-borabicyclo[3.3.1]non-9-yloxy)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.187566832 u |
| Formula | C14H27BOS |
| InChI | InChI=1S/C14H27BOS/c17-12-4-2-1-3-11-16-15-13-7-5-8-14(15)10-6-9-13/h13-14,17H,1-12H2/t13-,14+ |
| InChIKey | MNROILAJDXVCTB-OKILXGFUSA-N |
| Molecular Weight | 254.239 g/mol |
| SMILES | C1CC[C@]2(B([C@@]1(CCC2)[H])OCCCCCCS)[H] |