SpectraBase Compound ID | 4E0l4BoFphh |
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InChI | InChI=1S/C10H7ClN4/c11-8-4-2-1-3-6(8)9-7(5-12)10(13)15-14-9/h1-4H,(H3,13,14,15) |
InChIKey | QARYTBIJVCCHSO-UHFFFAOYSA-N |
Mol Weight | 218.65 g/mol |
Molecular Formula | C10H7ClN4 |
Exact Mass | 218.035924 g/mol |
SpectraBase Spectrum ID | F1tbjyGgbpA |
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Name | 3-Amino-5-(2-chlorophenyl)-1H-pyrazole-4-carbonitrile |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 218.035923941 u |
Formula | C10H7ClN4 |
InChI | InChI=1S/C10H7ClN4/c11-8-4-2-1-3-6(8)9-7(5-12)10(13)15-14-9/h1-4H,(H3,13,14,15) |
InChIKey | QARYTBIJVCCHSO-UHFFFAOYSA-N |
SMILES | C1(=C(NN=C1N)C=1C(Cl)=CC=CC1)C#N |