| SpectraBase Compound ID | 5wTbOBmp3rN |
|---|---|
| InChI | InChI=1S/C10H8BrN3O2/c1-7-10(11)6-13(12-7)8-2-4-9(5-3-8)14(15)16/h2-6H,1H3 |
| InChIKey | RYABIBSXBCVDTJ-UHFFFAOYSA-N |
| Mol Weight | 282.1 g/mol |
| Molecular Formula | C10H8BrN3O2 |
| Exact Mass | 280.97999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ej7otvekDAq |
|---|---|
| Name | 4-Bromo-3-methyl-1-(p-nitrophenyl)pyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.979989508 u |
| Formula | C10H8BrN3O2 |
| InChI | InChI=1S/C10H8BrN3O2/c1-7-10(11)6-13(12-7)8-2-4-9(5-3-8)14(15)16/h2-6H,1H3 |
| InChIKey | RYABIBSXBCVDTJ-UHFFFAOYSA-N |
| SMILES | N(=O)(=O)C1=CC=C(C=C1)N1C=C(C(=N1)C)Br |