![1-Propanone, 1-[4-(4-methyl-3-pentenyl)-3-cyclohexen-1-yl]-](/api/spectrum/IyXnLJ0WR42/structure.png?h=300&w=458 "1-Propanone, 1-[4-(4-methyl-3-pentenyl)-3-cyclohexen-1-yl]-")
| SpectraBase Compound ID | AKehq7b1n3K |
|---|---|
| InChI | InChI=1S/C15H24O/c1-4-15(16)14-10-8-13(9-11-14)7-5-6-12(2)3/h6,8,14H,4-5,7,9-11H2,1-3H3 |
| InChIKey | NQAAPQHAMZZYIR-UHFFFAOYSA-N |
| Mol Weight | 220.36 g/mol |
| Molecular Formula | C15H24O |
| Exact Mass | 220.182715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IyXnLJ0WR42 |
|---|---|
| Name | 1-Propanone, 1-[4-(4-methyl-3-pentenyl)-3-cyclohexen-1-yl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.182715392 u |
| Formula | C15H24O |
| InChI | InChI=1S/C15H24O/c1-4-15(16)14-10-8-13(9-11-14)7-5-6-12(2)3/h6,8,14H,4-5,7,9-11H2,1-3H3 |
| InChIKey | NQAAPQHAMZZYIR-UHFFFAOYSA-N |
| Molecular Weight | 220.356 g/mol |
| SMILES | C1=C(CCC(C(=O)CC)C1)CCC=C(C)C |