| SpectraBase Compound ID | H3lChfxnROy |
|---|---|
| InChI | InChI=1S/C13H11N3O5/c1-21-11-4-2-3-9(7-11)14-12-6-5-10(15(17)18)8-13(12)16(19)20/h2-8,14H,1H3 |
| InChIKey | WQUJWAFXGOBBCX-UHFFFAOYSA-N |
| Mol Weight | 289.25 g/mol |
| Molecular Formula | C13H11N3O5 |
| Exact Mass | 289.06987 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A0HiuZAgh46 |
|---|---|
| Name | 2,4-Dinitro-3'-methoxydipenylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.069870461 u |
| Formula | C13H11N3O5 |
| InChI | InChI=1S/C13H11N3O5/c1-21-11-4-2-3-9(7-11)14-12-6-5-10(15(17)18)8-13(12)16(19)20/h2-8,14H,1H3 |
| InChIKey | WQUJWAFXGOBBCX-UHFFFAOYSA-N |
| Molecular Weight | 289.247 g/mol |
| SMILES | N(C=1C=C(C=CC1)OC)C=1C=CC(=CC1N(=O)=O)N(=O)=O |