| SpectraBase Compound ID | LixAisgMSgU |
|---|---|
| InChI | InChI=1S/C9H7N3O2/c13-12(14)8-6-10-9(11-8)7-4-2-1-3-5-7/h1-6H,(H,10,11) |
| InChIKey | OIIFBUDLPDQPRC-UHFFFAOYSA-N |
| Mol Weight | 189.17 g/mol |
| Molecular Formula | C9H7N3O2 |
| Exact Mass | 189.053826 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ej5aPI19WXG |
|---|---|
| Name | 4-Nitro-2-phenyl-1H-imidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.053826475 u |
| Formula | C9H7N3O2 |
| InChI | InChI=1S/C9H7N3O2/c13-12(14)8-6-10-9(11-8)7-4-2-1-3-5-7/h1-6H,(H,10,11) |
| InChIKey | OIIFBUDLPDQPRC-UHFFFAOYSA-N |
| Molecular Weight | 189.174 g/mol |
| SMILES | C=1(N=C(C=2C=CC=CC2)NC1)N(=O)=O |