| SpectraBase Compound ID | IWfxMHUW2Of |
|---|---|
| InChI | InChI=1S/C9H9ClN4O4/c1-6(5-10)11-12-8-3-2-7(13(15)16)4-9(8)14(17)18/h2-4,12H,5H2,1H3/b11-6- |
| InChIKey | OEZNWZBWWXQDRS-WDZFZDKYSA-N |
| Mol Weight | 272.65 g/mol |
| Molecular Formula | C9H9ClN4O4 |
| Exact Mass | 272.031232 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HwuhUAETug1 |
|---|---|
| Name | 4'-Bromo-2-chloroacetophenone, 2,4-dinitrophenylhydrazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.031232482 u |
| Formula | C9H9ClN4O4 |
| InChI | InChI=1S/C9H9ClN4O4/c1-6(5-10)11-12-8-3-2-7(13(15)16)4-9(8)14(17)18/h2-4,12H,5H2,1H3/b11-6- |
| InChIKey | OEZNWZBWWXQDRS-WDZFZDKYSA-N |
| Molecular Weight | 272.648 g/mol |
| SMILES | N(\N=C\(C)CCl)C=1C=CC(=CC1N(=O)=O)N(=O)=O |