SpectraBase Compound ID | 833PCOYS22x |
---|---|
InChI | InChI=1S/C12H12ClN3O/c1-8-6-12(14-9(2)17)16(15-8)11-5-3-4-10(13)7-11/h3-7H,1-2H3,(H,14,17) |
InChIKey | YLALWTNPCFPKJN-UHFFFAOYSA-N |
Mol Weight | 249.7 g/mol |
Molecular Formula | C12H12ClN3O |
Exact Mass | 249.06689 g/mol |
SpectraBase Spectrum ID | Jq96YMOlot |
---|---|
Name | 1-(3-Chlorophenyl)-3-methyl-1H-pyrazol-5-amine, N-acetyl |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 249.066889717 u |
Formula | C12H12ClN3O |
InChI | InChI=1S/C12H12ClN3O/c1-8-6-12(14-9(2)17)16(15-8)11-5-3-4-10(13)7-11/h3-7H,1-2H3,(H,14,17) |
InChIKey | YLALWTNPCFPKJN-UHFFFAOYSA-N |
Molecular Weight | 249.701 g/mol |
SMILES | C1(=NN(C(=C1)NC(=O)C)C1=CC(=CC=C1)Cl)C |