| SpectraBase Compound ID | LhEwHfj5DwN |
|---|---|
| InChI | InChI=1S/C20H22O2/c1-20(2,3)15-22-18-12-10-17(11-13-18)19(21)14-9-16-7-5-4-6-8-16/h4-14H,15H2,1-3H3/b14-9+ |
| InChIKey | GWSSIRXYBKYFFM-NTEUORMPSA-N |
| Mol Weight | 294.39 g/mol |
| Molecular Formula | C20H22O2 |
| Exact Mass | 294.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D4T5tFxzV8w |
|---|---|
| Name | 4'-(Neopentyl)oxychalcone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.161979946 u |
| Formula | C20H22O2 |
| InChI | InChI=1S/C20H22O2/c1-20(2,3)15-22-18-12-10-17(11-13-18)19(21)14-9-16-7-5-4-6-8-16/h4-14H,15H2,1-3H3/b14-9+ |
| InChIKey | GWSSIRXYBKYFFM-NTEUORMPSA-N |
| SMILES | C1(=CC=C(C=C1)OCC(C)(C)C)C(\C=C\C=1C=CC=CC1)=O |