| SpectraBase Compound ID | FBhsnavmMFz |
|---|---|
| InChI | InChI=1S/C12H7Cl2NO/c13-9-3-4-11(14)10(6-9)12(16)8-2-1-5-15-7-8/h1-7H |
| InChIKey | BLNDOFZULNEYPR-UHFFFAOYSA-N |
| Mol Weight | 252.1 g/mol |
| Molecular Formula | C12H7Cl2NO |
| Exact Mass | 250.990469 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AW4AGc9auof |
|---|---|
| Name | Methanone, (2,5-dichlorophenyl)-3-pyridinyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.990469248 u |
| Formula | C12H7Cl2NO |
| InChI | InChI=1S/C12H7Cl2NO/c13-9-3-4-11(14)10(6-9)12(16)8-2-1-5-15-7-8/h1-7H |
| InChIKey | BLNDOFZULNEYPR-UHFFFAOYSA-N |
| Molecular Weight | 252.100 g/mol |
| SMILES | C1(C(C=2C=NC=CC2)=O)=C(C=CC(=C1)Cl)Cl |