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6-Amino-3-(4-chlorophenyl)-4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID 9ZspDQh0xKJ
InChI InChI=1S/C22H14ClFN6O/c23-13-5-1-12(2-6-13)20-18-17(15(9-25)21(26)31-22(18)30-29-20)16-10-27-28-19(16)11-3-7-14(24)8-4-11/h1-8,10,17H,26H2,(H,27,28)(H,29,30)
InChIKey KGAWUBBDLNDWIC-UHFFFAOYSA-N
Mol Weight 432.85 g/mol
Molecular Formula C22H14ClFN6O
Exact Mass 432.090165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KihImVQec2W
Name 6-Amino-3-(4-chlorophenyl)-4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H14ClFN6O
InChI InChI=1S/C22H14ClFN6O/c23-13-5-1-12(2-6-13)20-18-17(15(9-25)21(26)31-22(18)30-29-20)16-10-27-28-19(16)11-3-7-14(24)8-4-11/h1-8,10,17H,26H2,(H,27,28)(H,29,30)
InChIKey KGAWUBBDLNDWIC-UHFFFAOYSA-N
Molecular Weight 432.846 g/mol
SMILES [nH]1nc(c(C2c3c(OC(=C2C#N)N)[nH]nc3-c2ccc(cc2)Cl)c1)-c1ccc(cc1)F
SPLASH splash10-014u-9821000000-480c0626e4e9c17630ad
Synonyms 6-Azanyl-3-(4-chlorophenyl)-4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Wiley ID 1457817