| SpectraBase Compound ID | 6sC76OgVobO |
|---|---|
| InChI | InChI=1S/C9H6BrClN2/c10-7-5-12-13(6-7)9-3-1-2-8(11)4-9/h1-6H |
| InChIKey | NBPPIFVBFATSSA-UHFFFAOYSA-N |
| Mol Weight | 257.52 g/mol |
| Molecular Formula | C9H6BrClN2 |
| Exact Mass | 255.940289 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2LI0YuWii1T |
|---|---|
| Name | 4-Bromo-1-(3-chlorophenyl)-1H-pyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.940288901 u |
| Formula | C9H6BrClN2 |
| InChI | InChI=1S/C9H6BrClN2/c10-7-5-12-13(6-7)9-3-1-2-8(11)4-9/h1-6H |
| InChIKey | NBPPIFVBFATSSA-UHFFFAOYSA-N |
| SMILES | C1(Cl)=CC(=CC=C1)N1N=CC(=C1)Br |