| SpectraBase Compound ID | 8Rw1pmUq6Vs |
|---|---|
| InChI | InChI=1S/C8H6Cl2N2O3/c9-7(10)8(13)11-5-2-1-3-6(4-5)12(14)15/h1-4,7H,(H,11,13) |
| InChIKey | MJSNGWQBPBCMJV-UHFFFAOYSA-N |
| Mol Weight | 249.05 g/mol |
| Molecular Formula | C8H6Cl2N2O3 |
| Exact Mass | 247.975547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DG8GtmrouBE |
|---|---|
| Name | Acetamide, N-(3-nitrophenyl)-2,2-dichloro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.975547458 u |
| Formula | C8H6Cl2N2O3 |
| InChI | InChI=1S/C8H6Cl2N2O3/c9-7(10)8(13)11-5-2-1-3-6(4-5)12(14)15/h1-4,7H,(H,11,13) |
| InChIKey | MJSNGWQBPBCMJV-UHFFFAOYSA-N |
| Molecular Weight | 249.053 g/mol |
| SMILES | C(C(=O)NC1=CC=CC(=C1)N(=O)=O)(Cl)Cl |