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Ethyl 4-(4-fluorophenyl)-1,3-diphenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate
SpectraBase Compound ID 68PbqmKHXW9
InChI InChI=1S/C27H20FN3O2/c1-2-33-27(32)23-17-22(18-13-15-20(28)16-14-18)24-25(19-9-5-3-6-10-19)30-31(26(24)29-23)21-11-7-4-8-12-21/h3-17H,2H2,1H3
InChIKey QAUIUEFWYBFVOK-UHFFFAOYSA-N
Mol Weight 437.47 g/mol
Molecular Formula C27H20FN3O2
Exact Mass 437.153955 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2RYNknaNTOf
Name Ethyl-4-(4-fluorophenyl)-1,3-diphenyl-1H-pyrazolo[3,4-B]-pyridine-6-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.153955057 u
Formula C27H20FN3O2
InChI InChI=1S/C27H20FN3O2/c1-2-33-27(32)23-17-22(18-13-15-20(28)16-14-18)24-25(19-9-5-3-6-10-19)30-31(26(24)29-23)21-11-7-4-8-12-21/h3-17H,2H2,1H3
InChIKey QAUIUEFWYBFVOK-UHFFFAOYSA-N
Molecular Weight 437.474 g/mol
SMILES C1=2C(=C(C=C(N2)C(=O)OCC)C=2C=CC(=CC2)F)C(=NN1C=1C=CC=CC1)C=1C=CC=CC1
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