| SpectraBase Compound ID | F03WQrZpcnT |
|---|---|
| InChI | InChI=1S/C22H15ClO2/c23-19-13-11-16(12-14-19)15-20(21(24)17-7-3-1-4-8-17)22(25)18-9-5-2-6-10-18/h1-15H |
| InChIKey | AHPVIBXXUMHCSE-UHFFFAOYSA-N |
| Mol Weight | 346.81 g/mol |
| Molecular Formula | C22H15ClO2 |
| Exact Mass | 346.076057 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G6Y8c8OBz6f |
|---|---|
| Name | 2-(4-Chlorobenzylidene)-1,3-diphenylpropane-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.076057421 u |
| Formula | C22H15ClO2 |
| InChI | InChI=1S/C22H15ClO2/c23-19-13-11-16(12-14-19)15-20(21(24)17-7-3-1-4-8-17)22(25)18-9-5-2-6-10-18/h1-15H |
| InChIKey | AHPVIBXXUMHCSE-UHFFFAOYSA-N |
| Molecular Weight | 346.813 g/mol |
| SMILES | C=1C=C(C(C(C(C2=CC=CC=C2)=O)=CC2=CC=C(C=C2)Cl)=O)C=CC1 |