| SpectraBase Compound ID | GrKpon6KHEj |
|---|---|
| InChI | InChI=1S/C10H18O/c1-5-8(2)6-7-9(3)10(4)11/h6,9H,5,7H2,1-4H3/b8-6+ |
| InChIKey | VSCXSOIJQDYIOX-SOFGYWHQSA-N |
| Mol Weight | 154.25 g/mol |
| Molecular Formula | C10H18O |
| Exact Mass | 154.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I9kfmy9MyXX |
|---|---|
| Name | 5-Octen-2-one, 3,6-dimethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.135765199 u |
| Formula | C10H18O |
| InChI | InChI=1S/C10H18O/c1-5-8(2)6-7-9(3)10(4)11/h6,9H,5,7H2,1-4H3/b8-6+ |
| InChIKey | VSCXSOIJQDYIOX-SOFGYWHQSA-N |
| Molecular Weight | 154.253 g/mol |
| SMILES | CC\C(=C\CC(C(C)=O)C)C |