| SpectraBase Compound ID | 5scc3Ed5PYx |
|---|---|
| InChI | InChI=1S/C20H15N3O4/c24-19(14-7-3-1-4-8-14)21-17-12-11-16(23(26)27)13-18(17)22-20(25)15-9-5-2-6-10-15/h1-13H,(H,21,24)(H,22,25) |
| InChIKey | MTUBWAMJLNCCHT-UHFFFAOYSA-N |
| Mol Weight | 361.36 g/mol |
| Molecular Formula | C20H15N3O4 |
| Exact Mass | 361.106256 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1DreJX6pY2t |
|---|---|
| Name | 3,4-Dibenzamido-nitro-benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 361.106255971 u |
| Formula | C20H15N3O4 |
| InChI | InChI=1S/C20H15N3O4/c24-19(14-7-3-1-4-8-14)21-17-12-11-16(23(26)27)13-18(17)22-20(25)15-9-5-2-6-10-15/h1-13H,(H,21,24)(H,22,25) |
| InChIKey | MTUBWAMJLNCCHT-UHFFFAOYSA-N |
| Molecular Weight | 361.357 g/mol |
| SMILES | C1(=C(C=CC(=C1)N(=O)=O)NC(=O)C1=CC=CC=C1)NC(=O)C1=CC=CC=C1 |