![Phenol, 4-[bis(3-nitrophenyl)amino]-](/api/spectrum/83u5XzStgCX/structure.png?h=300&w=458 "Phenol, 4-[bis(3-nitrophenyl)amino]-")
| SpectraBase Compound ID | E7ngsE82lVm |
|---|---|
| InChI | InChI=1S/C18H13N3O5/c22-18-9-7-13(8-10-18)19(14-3-1-5-16(11-14)20(23)24)15-4-2-6-17(12-15)21(25)26/h1-12,22H |
| InChIKey | IYXHHKNPUCZDCR-UHFFFAOYSA-N |
| Mol Weight | 351.32 g/mol |
| Molecular Formula | C18H13N3O5 |
| Exact Mass | 351.085521 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 83u5XzStgCX |
|---|---|
| Name | Phenol, 4-[bis(3-nitrophenyl)amino]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 351.085520526 u |
| Formula | C18H13N3O5 |
| InChI | InChI=1S/C18H13N3O5/c22-18-9-7-13(8-10-18)19(14-3-1-5-16(11-14)20(23)24)15-4-2-6-17(12-15)21(25)26/h1-12,22H |
| InChIKey | IYXHHKNPUCZDCR-UHFFFAOYSA-N |
| Molecular Weight | 351.318 g/mol |
| SMILES | C1(N(=O)=O)=CC(N(C=2C=C(N(=O)=O)C=CC2)C=2C=CC(=CC2)O)=CC=C1 |