![2-Propen-1-one, 3-[4-(1-methylethyl)phenyl]-1-phenyl-](/api/spectrum/6u3sl42Gtuj/structure.png?h=300&w=458 "2-Propen-1-one, 3-[4-(1-methylethyl)phenyl]-1-phenyl-")
| SpectraBase Compound ID | FijuRm7P6iG |
|---|---|
| InChI | InChI=1S/C18H18O/c1-14(2)16-11-8-15(9-12-16)10-13-18(19)17-6-4-3-5-7-17/h3-14H,1-2H3/b13-10+ |
| InChIKey | HQIRFTXJWVJMEU-JLHYYAGUSA-N |
| Mol Weight | 250.34 g/mol |
| Molecular Formula | C18H18O |
| Exact Mass | 250.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6u3sl42Gtuj |
|---|---|
| Name | 2-Propen-1-one, 3-[4-(1-methylethyl)phenyl]-1-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.135765199 u |
| Formula | C18H18O |
| InChI | InChI=1S/C18H18O/c1-14(2)16-11-8-15(9-12-16)10-13-18(19)17-6-4-3-5-7-17/h3-14H,1-2H3/b13-10+ |
| InChIKey | HQIRFTXJWVJMEU-JLHYYAGUSA-N |
| Molecular Weight | 250.341 g/mol |
| SMILES | C(\C=C\C1=CC=C(C(C)C)C=C1)(=O)C1=CC=CC=C1 |