| SpectraBase Compound ID | FkE0ZfuFhPy |
|---|---|
| InChI | InChI=1S/C14H11Cl2NO/c15-12-5-3-10(13(16)8-12)4-6-14(18)11-2-1-7-17-9-11/h1-3,5,7-9H,4,6H2 |
| InChIKey | VZNGRVCWFXPYBG-UHFFFAOYSA-N |
| Mol Weight | 280.15 g/mol |
| Molecular Formula | C14H11Cl2NO |
| Exact Mass | 279.021769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8LI6448tKhg |
|---|---|
| Name | 1-Propanone, 3-(2,4-dichlorophenyl)-1-(3-pyridinyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.021769377 u |
| Formula | C14H11Cl2NO |
| InChI | InChI=1S/C14H11Cl2NO/c15-12-5-3-10(13(16)8-12)4-6-14(18)11-2-1-7-17-9-11/h1-3,5,7-9H,4,6H2 |
| InChIKey | VZNGRVCWFXPYBG-UHFFFAOYSA-N |
| SMILES | C1(=C(C=CC(=C1)Cl)CCC(C=1C=NC=CC1)=O)Cl |