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7-(2,4-dimethylphenyl)-3-methyl-1-phenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylic acid methyl ester
SpectraBase Compound ID K9DCRHLOcbA
InChI InChI=1S/C23H22N4O2/c1-14-10-11-18(15(2)12-14)19-13-20(23(28)29-4)24-21-16(3)26-27(22(21)25-19)17-8-6-5-7-9-17/h5-12H,13H2,1-4H3
InChIKey DUDPBGAILYCANN-UHFFFAOYSA-N
Mol Weight 386.46 g/mol
Molecular Formula C23H22N4O2
Exact Mass 386.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KLFsdzeCC0A
Name 7-(2,4-dimethylphenyl)-3-methyl-1-phenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22N4O2
InChI InChI=1S/C23H22N4O2/c1-14-10-11-18(15(2)12-14)19-13-20(23(28)29-4)24-21-16(3)26-27(22(21)25-19)17-8-6-5-7-9-17/h5-12H,13H2,1-4H3
InChIKey DUDPBGAILYCANN-UHFFFAOYSA-N
Molecular Weight 386.455 g/mol
SMILES c12c(N=C(C(=O)OC)CC(=N2)c2c(cc(cc2)C)C)c(C)n[n]1-c1ccccc1
SPLASH splash10-000i-2339000000-b3bff3e9d5633e394924
Source of Spectrum O1-28-2067-5
Synonyms Methyl 7-(2,4-dimethylphenyl)-3-methyl-1-phenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylate
Wiley ID 818312