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3-(4-Chlorophenyl)-1-(quinolin-2-yl)-1H-pyrazolo[3,4-d]pyrimidine
SpectraBase Compound ID H4BWGl4BSw5
InChI InChI=1S/C20H12ClN5/c21-15-8-5-14(6-9-15)19-16-11-22-12-23-20(16)26(25-19)18-10-7-13-3-1-2-4-17(13)24-18/h1-12H
InChIKey OOQKRYAUZWXDBW-UHFFFAOYSA-N
Mol Weight 357.8 g/mol
Molecular Formula C20H12ClN5
Exact Mass 357.078123 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EuYVTqzWE0
Name 3-(4-Chlorophenyl)-1-(quinolin-2-yl)-1H-pyrazolo[3,4-d]pyrimidine
Alternate Name(s) 2-[3-(4-chlorophenyl)-1-pyrazolo[3,4-d]pyrimidinyl]quinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12ClN5
InChI InChI=1S/C20H12ClN5/c21-15-8-5-14(6-9-15)19-16-11-22-12-23-20(16)26(25-19)18-10-7-13-3-1-2-4-17(13)24-18/h1-12H
InChIKey OOQKRYAUZWXDBW-UHFFFAOYSA-N
Molecular Weight 357.804 g/mol
SMILES c1nc2c(cn1)c(n[n]2-c1nc2ccccc2cc1)-c1ccc(cc1)Cl
SPLASH splash10-0a4i-0419000000-81d3adf1e9b4ad023950
Source of Spectrum F-68-9663-55
Wiley ID 1717843