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CHEBI:120999 - 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid methyl ester
| Formula | C11H9BrN2O2 |
| Net Charge | 0 |
| Average Mass | 281.109 |
| Monoisotopic Mass | 279.98474 |
| SMILES | COC(=O)c1cc(-c2ccc(Br)cc2)nn1 |
| InChI | InChI=1S/C11H9BrN2O2/c1-16-11(15)10-6-9(13-14-10)7-2-4-8(12)5-3-7/h2-6H,1H3,(H,13,14) |
| InChIKey | IRKMOAWZRZMSCU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid methyl ester (CHEBI:120999) is a pyrazoles (CHEBI:26410) |
| 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid methyl ester (CHEBI:120999) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32442 | LINCS |