| SpectraBase Compound ID | 3olR7PM1Dia |
|---|---|
| InChI | InChI=1S/C11H20O/c1-6-9(2)7-8-10(12)11(3,4)5/h7-9H,6H2,1-5H3/b8-7+/t9-/m1/s1 |
| InChIKey | XGBIOFQJXMZZAG-FCZSHJHJSA-N |
| Mol Weight | 168.28 g/mol |
| Molecular Formula | C11H20O |
| Exact Mass | 168.151415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | l4DidgadCq |
|---|---|
| Name | (-)-(6R,4E)- 2,2,6-trimethyl-oct-4-en-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.151415263 u |
| Formula | C11H20O |
| InChI | InChI=1S/C11H20O/c1-6-9(2)7-8-10(12)11(3,4)5/h7-9H,6H2,1-5H3/b8-7+/t9-/m1/s1 |
| InChIKey | XGBIOFQJXMZZAG-FCZSHJHJSA-N |
| Molecular Weight | 168.280 g/mol |
| SMILES | C(C(=O)\C=C\[C@@](CC)(C)[H])(C)(C)C |