![Ethyl 5-[4-pyridyl]-4-bromopyrazole-3-carboxylate](/api/spectrum/2mmert7nZs5/structure.png?h=300&w=458 "Ethyl 5-[4-pyridyl]-4-bromopyrazole-3-carboxylate")
| SpectraBase Compound ID | 6hM7xhm9Iqw |
|---|---|
| InChI | InChI=1S/C11H10BrN3O2/c1-2-17-11(16)10-8(12)9(14-15-10)7-3-5-13-6-4-7/h3-6H,2H2,1H3,(H,14,15) |
| InChIKey | MTJKUQRMTMGCGY-UHFFFAOYSA-N |
| Mol Weight | 296.12 g/mol |
| Molecular Formula | C11H10BrN3O2 |
| Exact Mass | 294.99564 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2mmert7nZs5 |
|---|---|
| Name | Ethyl 5-[4-pyridyl]-4-bromopyrazole-3-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.995639572 u |
| Formula | C11H10BrN3O2 |
| InChI | InChI=1S/C11H10BrN3O2/c1-2-17-11(16)10-8(12)9(14-15-10)7-3-5-13-6-4-7/h3-6H,2H2,1H3,(H,14,15) |
| InChIKey | MTJKUQRMTMGCGY-UHFFFAOYSA-N |
| Molecular Weight | 296.124 g/mol |
| SMILES | C1(=CC=NC=C1)C1=NNC(=C1Br)C(OCC)=O |