| SpectraBase Compound ID | E4xzMSV3GeC |
|---|---|
| InChI | InChI=1S/C15H8Cl2O/c16-13-8-5-12(6-9-13)15(18)10-7-11-3-1-2-4-14(11)17/h1-6,8-9H |
| InChIKey | MXSZCJAKSTZBJS-UHFFFAOYSA-N |
| Mol Weight | 275.13 g/mol |
| Molecular Formula | C15H8Cl2O |
| Exact Mass | 273.99522 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CHhofG9modZ |
|---|---|
| Name | 3-(4-Chlorophenyl)-1-(2-chlorophenyl)propynone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.995220277 u |
| Formula | C15H8Cl2O |
| InChI | InChI=1S/C15H8Cl2O/c16-13-8-5-12(6-9-13)15(18)10-7-11-3-1-2-4-14(11)17/h1-6,8-9H |
| InChIKey | MXSZCJAKSTZBJS-UHFFFAOYSA-N |
| SMILES | C(#CC=1C(Cl)=CC=CC1)C(C1=CC=C(C=C1)Cl)=O |