| SpectraBase Compound ID | KpIZUHedUeO |
|---|---|
| InChI | InChI=1S/C14H10ClN3O5/c1-8-2-4-10(17(20)21)7-12(8)16-14(19)11-5-3-9(15)6-13(11)18(22)23/h2-7H,1H3,(H,16,19) |
| InChIKey | JXLUSNSGHKUZRB-UHFFFAOYSA-N |
| Mol Weight | 335.7 g/mol |
| Molecular Formula | C14H10ClN3O5 |
| Exact Mass | 335.030898 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2J6O5TJBn2W |
|---|---|
| Name | 4-Chloro-N-(2-methyl-5-nitrophenyl)-2-nitrobenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 335.030898129 u |
| Formula | C14H10ClN3O5 |
| InChI | InChI=1S/C14H10ClN3O5/c1-8-2-4-10(17(20)21)7-12(8)16-14(19)11-5-3-9(15)6-13(11)18(22)23/h2-7H,1H3,(H,16,19) |
| InChIKey | JXLUSNSGHKUZRB-UHFFFAOYSA-N |
| Molecular Weight | 335.703 g/mol |
| SMILES | C1=C(C(=CC=C1N(=O)=O)C)NC(C1=C(C=C(C=C1)Cl)N(=O)=O)=O |