| SpectraBase Compound ID | HPNfupcri8 |
|---|---|
| InChI | InChI=1S/C16H26O/c1-4-5-6-7-8-9-10-14-11-15(17)13-16(2,3)12-14/h9-11H,4-8,12-13H2,1-3H3/b10-9+ |
| InChIKey | JAIWUHDOBXCIIC-MDZDMXLPSA-N |
| Mol Weight | 234.38 g/mol |
| Molecular Formula | C16H26O |
| Exact Mass | 234.198365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AzAQNOTz2xO |
|---|---|
| Name | (E)-5,5-Dimethyl-3-(1-octenyl)-2-cyclohexen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.198365456 u |
| Formula | C16H26O |
| InChI | InChI=1S/C16H26O/c1-4-5-6-7-8-9-10-14-11-15(17)13-16(2,3)12-14/h9-11H,4-8,12-13H2,1-3H3/b10-9+ |
| InChIKey | JAIWUHDOBXCIIC-MDZDMXLPSA-N |
| Molecular Weight | 234.383 g/mol |
| SMILES | C1(=CC(=O)CC(C1)(C)C)\C=C\CCCCCC |