| SpectraBase Compound ID | FxCL5zJc9nS |
|---|---|
| InChI | InChI=1S/C10H18.CH4O/c1-9(2)8-4-6-10(9,3)7-5-8;1-2/h8H,4-7H2,1-3H3;2H,1H3/t8-,10+; |
| InChIKey | OCTJDMNMECKDIN-OFAZAQPOSA-N |
| Mol Weight | 170.3 g/mol |
| Molecular Formula | C11H22O |
| Exact Mass | 170.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9j1KxiN6RRN |
|---|---|
| Name | nan |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.167065327 u |
| Formula | C11H22O |
| InChI | InChI=1S/C10H18.CH4O/c1-9(2)8-4-6-10(9,3)7-5-8;1-2/h8H,4-7H2,1-3H3;2H,1H3/t8-,10+; |
| InChIKey | OCTJDMNMECKDIN-OFAZAQPOSA-N |
| Molecular Weight | 170.296 g/mol |
| SMILES | OC.C1C[C@]2(CC[C@@]1(C2(C)C)C)[H] |