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4-(4-Chlorophenyl)-2-(1-(4-chlorophenyl)-3-(4-methoxyphenyl)- 1H-pyrazol-4-yl)-1-(4-fluorophenyl)butan-1,4-dione
SpectraBase Compound ID 2E03PVETVLc
InChI InChI=1S/C32H23Cl2FN2O3/c1-40-27-16-6-21(7-17-27)31-29(19-37(36-31)26-14-10-24(34)11-15-26)28(32(39)22-4-12-25(35)13-5-22)18-30(38)20-2-8-23(33)9-3-20/h2-17,19,28H,18H2,1H3
InChIKey WTBFOGXCIHQKSB-UHFFFAOYSA-N
Mol Weight 573.5 g/mol
Molecular Formula C32H23Cl2FN2O3
Exact Mass 572.106976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UoUYyZennh
Name 4-(4-Chlorophenyl)-2-(1-(4-chlorophenyl)-3-(4-methoxyphenyl)- 1H-pyrazol-4-yl)-1-(4-fluorophenyl)butan-1,4-dione
Alternate Name(s) 4-(4-Chlorophenyl)-2-(1-(4-chlorophenyl)-3-(4-methoxyphenyl)-1H-pyrazol-4-yl)-1-(4-fluorophenyl)butane-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H23Cl2FN2O3
InChI InChI=1S/C32H23Cl2FN2O3/c1-40-27-16-6-21(7-17-27)31-29(19-37(36-31)26-14-10-24(34)11-15-26)28(32(39)22-4-12-25(35)13-5-22)18-30(38)20-2-8-23(33)9-3-20/h2-17,19,28H,18H2,1H3
InChIKey WTBFOGXCIHQKSB-UHFFFAOYSA-N
Molecular Weight 573.451 g/mol
SMILES C(C(CC(=O)c1ccc(cc1)Cl)c1c(n[n](c1)-c1ccc(cc1)Cl)-c1ccc(cc1)OC)(=O)c1ccc(cc1)F
SPLASH splash10-01pa-9721000000-c638a3639ac2d39425bd
Source of Spectrum Fatma A. Ragab, et al. European Journal of Medicinal Chemistry, V.63, 2013, P.645-654
Wiley ID 1816887