| SpectraBase Compound ID | LfZbvinJqSF |
|---|---|
| InChI | InChI=1S/C19H22O2/c20-18-9-5-4-8-15(18)13-17-11-10-16(19(17)21)12-14-6-2-1-3-7-14/h1-3,6-7,12,15,17H,4-5,8-11,13H2/b16-12+ |
| InChIKey | QZXWIUANAKDALS-FOWTUZBSSA-N |
| Mol Weight | 282.38 g/mol |
| Molecular Formula | C19H22O2 |
| Exact Mass | 282.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5n3TYJ0sH50 |
|---|---|
| Name | (3-Benzylidene-2-oxocyclopentyl)(2-oxocyclohexyl)methane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.161979946 u |
| Formula | C19H22O2 |
| InChI | InChI=1S/C19H22O2/c20-18-9-5-4-8-15(18)13-17-11-10-16(19(17)21)12-14-6-2-1-3-7-14/h1-3,6-7,12,15,17H,4-5,8-11,13H2/b16-12+ |
| InChIKey | QZXWIUANAKDALS-FOWTUZBSSA-N |
| SMILES | C1(\C(CCC1CC1C(=O)CCCC1)=C\C=1C=CC=CC1)=O |