| SpectraBase Compound ID | GKHqCdPSJo1 |
|---|---|
| InChI | InChI=1S/C14H28O/c1-7-11(2)10-13(14(4,5)6)9-8-12(3)15/h11,13H,7-10H2,1-6H3 |
| InChIKey | OSWIYRIKOGCSNH-UHFFFAOYSA-N |
| Mol Weight | 212.38 g/mol |
| Molecular Formula | C14H28O |
| Exact Mass | 212.214016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3j3yqILUt0 |
|---|---|
| Name | 5-Tert-butyl-7-methylnonan-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.214015521 u |
| Formula | C14H28O |
| InChI | InChI=1S/C14H28O/c1-7-11(2)10-13(14(4,5)6)9-8-12(3)15/h11,13H,7-10H2,1-6H3 |
| InChIKey | OSWIYRIKOGCSNH-UHFFFAOYSA-N |
| Molecular Weight | 212.377 g/mol |
| SMILES | CC(CCC(CC(CC)C)C(C)(C)C)=O |