| SpectraBase Compound ID | C5xA9PjPCoe |
|---|---|
| InChI | InChI=1S/C12H11N3O4S/c13-9-1-3-10(4-2-9)14-20(18,19)12-7-5-11(6-8-12)15(16)17/h1-8,14H,13H2 |
| InChIKey | CAKJRDDZMNGEKR-UHFFFAOYSA-N |
| Mol Weight | 293.3 g/mol |
| Molecular Formula | C12H11N3O4S |
| Exact Mass | 293.047027 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Q5LLVo2tsB |
|---|---|
| Name | Benzenesulfonamide, N-(4-aminophenyl)-4-nitro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.047027016 u |
| Formula | C12H11N3O4S |
| InChI | InChI=1S/C12H11N3O4S/c13-9-1-3-10(4-2-9)14-20(18,19)12-7-5-11(6-8-12)15(16)17/h1-8,14H,13H2 |
| InChIKey | CAKJRDDZMNGEKR-UHFFFAOYSA-N |
| SMILES | C1(N)=CC=C(C=C1)NS(=O)(=O)C1=CC=C(C=C1)N(=O)=O |