| SpectraBase Compound ID | HvidJ9FaM0F |
|---|---|
| InChI | InChI=1S/C13H8N2O5/c16-13(9-5-7-10(8-6-9)14(17)18)11-3-1-2-4-12(11)15(19)20/h1-8H |
| InChIKey | FHWMEUDUPATLNE-UHFFFAOYSA-N |
| Mol Weight | 272.22 g/mol |
| Molecular Formula | C13H8N2O5 |
| Exact Mass | 272.043321 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LRMZqqF5ejL |
|---|---|
| Name | (2-Nitrophenyl)-(4-nitrophenyl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.043321361 u |
| Formula | C13H8N2O5 |
| InChI | InChI=1S/C13H8N2O5/c16-13(9-5-7-10(8-6-9)14(17)18)11-3-1-2-4-12(11)15(19)20/h1-8H |
| InChIKey | FHWMEUDUPATLNE-UHFFFAOYSA-N |
| SMILES | C=1(N(=O)=O)C(C(C=2C=CC(N(=O)=O)=CC2)=O)=CC=CC1 |