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5-Amino-1-(4-chlorophenyl)-N3 -phenyl-N4 -(pyridin-2-yl)-1H-pyrazole-3,4-dicarboxamide
SpectraBase Compound ID 7UYJBXsCHy5
InChI InChI=1S/C22H17ClN6O2/c23-14-9-11-16(12-10-14)29-20(24)18(21(30)27-17-8-4-5-13-25-17)19(28-29)22(31)26-15-6-2-1-3-7-15/h1-13H,24H2,(H,26,31)(H,25,27,30)
InChIKey NNOKMYWWOVWZEL-UHFFFAOYSA-N
Mol Weight 432.87 g/mol
Molecular Formula C22H17ClN6O2
Exact Mass 432.110152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4NfowUFr8K
Name 5-Amino-1-(4-chlorophenyl)-N3 -phenyl-N4 -(pyridin-2-yl)-1H-pyrazole-3,4-dicarboxamide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17ClN6O2
InChI InChI=1S/C22H17ClN6O2/c23-14-9-11-16(12-10-14)29-20(24)18(21(30)27-17-8-4-5-13-25-17)19(28-29)22(31)26-15-6-2-1-3-7-15/h1-13H,24H2,(H,26,31)(H,25,27,30)
InChIKey NNOKMYWWOVWZEL-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.f16
Molecular Weight 432.871 g/mol
SMILES N(C(c1n[n](c(c1C(=O)Nc1ncccc1)N)-c1ccc(cc1)Cl)=O)c1ccccc1
SPLASH splash10-01q9-3308900000-3710c27bd7c5bf49f047
Source of Spectrum ARK-2008-171-4e
Wiley ID 1869289