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Ethyl 3-(p-chlorophenyl)-6-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
SpectraBase Compound ID DpUA8Us3UC1
InChI InChI=1S/C21H16ClN3O3/c1-2-28-21(27)17-12-16-18(13-8-10-14(22)11-9-13)24-25(19(16)23-20(17)26)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,23,26)
InChIKey BUEISZZWUFFZKS-UHFFFAOYSA-N
Mol Weight 393.83 g/mol
Molecular Formula C21H16ClN3O3
Exact Mass 393.088019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mjeRfLNBJa
Name Ethyl 3-(p-chlorophenyl)-6-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16ClN3O3
InChI InChI=1S/C21H16ClN3O3/c1-2-28-21(27)17-12-16-18(13-8-10-14(22)11-9-13)24-25(19(16)23-20(17)26)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,23,26)
InChIKey BUEISZZWUFFZKS-UHFFFAOYSA-N
Molecular Weight 393.830 g/mol
SMILES N1C(C(=Cc2c1[n](nc2-c1ccc(cc1)Cl)-c1ccccc1)C(=O)OCC)=O
SPLASH splash10-0006-0009000000-dee982fb21bf768875bd
Source of Spectrum AJ-42-1318-14
Synonyms Ethyl 3-(4-chlorophenyl)-6-oxo-1-phenyl-6,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
Wiley ID 1568238