| SpectraBase Compound ID | AiQWmxZfC6w |
|---|---|
| InChI | InChI=1S/C13H7Cl3N2O2/c14-11-4-2-10(18(19)20)5-8(11)7-17-9-1-3-12(15)13(16)6-9/h1-7H/b17-7+ |
| InChIKey | UJPKDPYMYGDVAN-REZTVBANSA-N |
| Mol Weight | 329.57 g/mol |
| Molecular Formula | C13H7Cl3N2O2 |
| Exact Mass | 327.957311 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4XH9JOViFRK |
|---|---|
| Name | N-(2-Chloro-5-nitrobenzylidene)-3,4-dichloroaniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.957310571 u |
| Formula | C13H7Cl3N2O2 |
| InChI | InChI=1S/C13H7Cl3N2O2/c14-11-4-2-10(18(19)20)5-8(11)7-17-9-1-3-12(15)13(16)6-9/h1-7H/b17-7+ |
| InChIKey | UJPKDPYMYGDVAN-REZTVBANSA-N |
| Molecular Weight | 329.570 g/mol |
| SMILES | C=1C(Cl)=C(Cl)C=C(C1)\N=C\C1=C(C=CC(=C1)N(=O)=O)Cl |