![4-[3-(3-Oxobutyl)but-3-en-1-yl]-3-phenylcyclohex-3-en-1-one](/api/spectrum/Kx5GhtyXBrR/structure.png?h=300&w=458 "4-[3-(3-Oxobutyl)but-3-en-1-yl]-3-phenylcyclohex-3-en-1-one")
| SpectraBase Compound ID | ICd7s7VpeWv |
|---|---|
| InChI | InChI=1S/C20H24O2/c1-15(8-10-16(2)21)9-11-18-12-13-19(22)14-20(18)17-6-4-3-5-7-17/h3-7H,1,8-14H2,2H3 |
| InChIKey | UBKNLSRBVFSMON-UHFFFAOYSA-N |
| Mol Weight | 296.41 g/mol |
| Molecular Formula | C20H24O2 |
| Exact Mass | 296.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kx5GhtyXBrR |
|---|---|
| Name | 4-[3-(3-Oxobutyl)but-3-en-1-yl]-3-phenylcyclohex-3-en-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.177630011 u |
| Formula | C20H24O2 |
| InChI | InChI=1S/C20H24O2/c1-15(8-10-16(2)21)9-11-18-12-13-19(22)14-20(18)17-6-4-3-5-7-17/h3-7H,1,8-14H2,2H3 |
| InChIKey | UBKNLSRBVFSMON-UHFFFAOYSA-N |
| SMILES | C1C(=O)CC(=C(C1)CCC(CCC(C)=O)=C)C=1C=CC=CC1 |