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Ethyl 5-Cyano-6,7-dihydro-6-oxo-3-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
SpectraBase Compound ID pdCtvTXFVc
InChI InChI=1S/C16H12N4O3/c1-2-23-16(22)11-10(8-17)15(21)18-14-12(11)13(19-20-14)9-6-4-3-5-7-9/h3-7H,2H2,1H3,(H2,18,19,20,21)
InChIKey MYYIDKSIBYZJHX-UHFFFAOYSA-N
Mol Weight 308.3 g/mol
Molecular Formula C16H12N4O3
Exact Mass 308.09094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12NbfHeJqrC
Name Ethyl 5-Cyano-6,7-dihydro-6-oxo-3-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N4O3
InChI InChI=1S/C16H12N4O3/c1-2-23-16(22)11-10(8-17)15(21)18-14-12(11)13(19-20-14)9-6-4-3-5-7-9/h3-7H,2H2,1H3,(H2,18,19,20,21)
InChIKey MYYIDKSIBYZJHX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200633
Molecular Weight 308.297 g/mol
SMILES N1C(C(=C(c2c(n[nH]c12)-c1ccccc1)C(=O)OCC)C#N)=O
SPLASH splash10-0a4i-3319000000-86bcd88f5a6d164cdc64
Source of Spectrum H-96-640-10e
Synonyms Ethyl 5-cyano-6-oxo-3-phenyl-6,7-dihydro-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
Wiley ID 1784712