![(2E)-2-[(4-chlorophenyl)methylene]-4-hydroxy-1-phenyl-butan-1-one](/api/spectrum/B51tL4NeoGr/structure.png?h=300&w=458 "(2E)-2-[(4-chlorophenyl)methylene]-4-hydroxy-1-phenyl-butan-1-one")
| SpectraBase Compound ID | 6HHhxNinzfm |
|---|---|
| InChI | InChI=1S/C17H15ClO2/c18-16-8-6-13(7-9-16)12-15(10-11-19)17(20)14-4-2-1-3-5-14/h1-9,12,19H,10-11H2/b15-12+ |
| InChIKey | XQYAJSPSQURYTC-NTCAYCPXSA-N |
| Mol Weight | 286.76 g/mol |
| Molecular Formula | C17H15ClO2 |
| Exact Mass | 286.076057 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B51tL4NeoGr |
|---|---|
| Name | (2E)-2-[(4-Chlorophenyl)methylene]-4-hydroxy-1-phenyl-butan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.076057421 u |
| Formula | C17H15ClO2 |
| InChI | InChI=1S/C17H15ClO2/c18-16-8-6-13(7-9-16)12-15(10-11-19)17(20)14-4-2-1-3-5-14/h1-9,12,19H,10-11H2/b15-12+ |
| InChIKey | XQYAJSPSQURYTC-NTCAYCPXSA-N |
| SMILES | C(\C(=C\C1=CC=C(C=C1)Cl)CCO)(=O)C=1C=CC=CC1 |