| SpectraBase Compound ID | J80OHN7VoiQ |
|---|---|
| InChI | InChI=1S/C11H11BrN2/c1-8-7-9(2)14(13-8)11-6-4-3-5-10(11)12/h3-7H,1-2H3 |
| InChIKey | YIRGHOVEEWNTPP-UHFFFAOYSA-N |
| Mol Weight | 251.13 g/mol |
| Molecular Formula | C11H11BrN2 |
| Exact Mass | 250.010561 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CQFBT5Du33N |
|---|---|
| Name | 1-(2-Bromophenyl)-3,5-dimethylpyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.010561362 u |
| Formula | C11H11BrN2 |
| InChI | InChI=1S/C11H11BrN2/c1-8-7-9(2)14(13-8)11-6-4-3-5-10(11)12/h3-7H,1-2H3 |
| InChIKey | YIRGHOVEEWNTPP-UHFFFAOYSA-N |
| Molecular Weight | 251.127 g/mol |
| SMILES | CC=1N(N=C(C1)C)C1=C(Br)C=CC=C1 |