| SpectraBase Compound ID | 3jqSm3b0Amu |
|---|---|
| InChI | InChI=1S/C13H11N3O4/c1-9-4-2-3-5-11(9)14-12-7-6-10(15(17)18)8-13(12)16(19)20/h2-8,14H,1H3 |
| InChIKey | OPGDEODYIMUSCO-UHFFFAOYSA-N |
| Mol Weight | 273.25 g/mol |
| Molecular Formula | C13H11N3O4 |
| Exact Mass | 273.074956 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GNJSz3k2umr |
|---|---|
| Name | N-(2,4-Dinitrophenyl)-o-toluidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.074955842 u |
| Formula | C13H11N3O4 |
| InChI | InChI=1S/C13H11N3O4/c1-9-4-2-3-5-11(9)14-12-7-6-10(15(17)18)8-13(12)16(19)20/h2-8,14H,1H3 |
| InChIKey | OPGDEODYIMUSCO-UHFFFAOYSA-N |
| Molecular Weight | 273.248 g/mol |
| SMILES | N(C=1C(=CC=CC1)C)C=1C=CC(=CC1N(=O)=O)N(=O)=O |