| SpectraBase Compound ID | GonClOYlHB1 |
|---|---|
| InChI | InChI=1S/C16H28O/c1-6-8-13(17)9-10-14-15(2,3)11-7-12-16(14,4)5/h9-10,14H,6-8,11-12H2,1-5H3/b10-9+ |
| InChIKey | KKGIJOFCCCBKQQ-MDZDMXLPSA-N |
| Mol Weight | 236.4 g/mol |
| Molecular Formula | C16H28O |
| Exact Mass | 236.214016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9uxh4rSTfUj |
|---|---|
| Name | 1-(2',2',6',6'-Tetramethylcyclohexyl)-hex-1-en-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.214015521 u |
| Formula | C16H28O |
| InChI | InChI=1S/C16H28O/c1-6-8-13(17)9-10-14-15(2,3)11-7-12-16(14,4)5/h9-10,14H,6-8,11-12H2,1-5H3/b10-9+ |
| InChIKey | KKGIJOFCCCBKQQ-MDZDMXLPSA-N |
| Molecular Weight | 236.399 g/mol |
| SMILES | C1(\C=C\C(=O)CCC)C(CCCC1(C)C)(C)C |