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diethyl 1,3-diphenylpyrazolo[3,4-b]pyridine-4,5-dicarboxylate
SpectraBase Compound ID L4CSNnvvcTN
InChI InChI=1S/C24H21N3O4/c1-3-30-23(28)18-15-25-22-20(19(18)24(29)31-4-2)21(16-11-7-5-8-12-16)26-27(22)17-13-9-6-10-14-17/h5-15H,3-4H2,1-2H3
InChIKey CCAVIWXKXAOYNT-UHFFFAOYSA-N
Mol Weight 415.45 g/mol
Molecular Formula C24H21N3O4
Exact Mass 415.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7JBcZVL4Ig
Name diethyl 1,3-diphenylpyrazolo[3,4-b]pyridine-4,5-dicarboxylate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.153206164 u
Formula C24H21N3O4
InChI InChI=1S/C24H21N3O4/c1-3-30-23(28)18-15-25-22-20(19(18)24(29)31-4-2)21(16-11-7-5-8-12-16)26-27(22)17-13-9-6-10-14-17/h5-15H,3-4H2,1-2H3
InChIKey CCAVIWXKXAOYNT-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701761
Molecular Weight 415.449 g/mol
Quality 120
Reported Formula C24H21N3O4
SMILES C1=NC2=C(C(=C1C(=O)OCC)C(OCC)=O)C(=NN2C1=CC=CC=C1)C1=CC=CC=C1
SPLASH splash10-014i-1030900000-8f4a72e502c82af15b3e
Source of Spectrum K1-2018-1569-3 (DOI: 10.1002/ejoc.201701761)
Wiley ID 1893991