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3H-pyrazol-3-one, 2-(3-chlorophenyl)-4-[[1-[(3,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl]methylene]-2,4-dihydro-5-methyl-

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3H-pyrazol-3-one, 2-(3-chlorophenyl)-4-[[1-[(3,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl]methylene]-2,4-dihydro-5-methyl-
SpectraBase Compound ID EH0kFdryiwI
InChI InChI=1S/C27H19Cl3N4O/c1-17-23(27(35)34(31-17)22-9-5-8-21(28)14-22)13-20-16-33(15-18-10-11-24(29)25(30)12-18)32-26(20)19-6-3-2-4-7-19/h2-14,16H,15H2,1H3/b23-13+
InChIKey QAAVTEKVRMOABW-YDZHTSKRSA-N
Mol Weight 521.84 g/mol
Molecular Formula C27H19Cl3N4O
Exact Mass 520.062444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6XQUMaiNZJF
Name 3H-pyrazol-3-one, 2-(3-chlorophenyl)-4-[[1-[(3,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl]methylene]-2,4-dihydro-5-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 520.062444347 u
Formula C27H19Cl3N4O
InChI InChI=1S/C27H19Cl3N4O/c1-17-23(27(35)34(31-17)22-9-5-8-21(28)14-22)13-20-16-33(15-18-10-11-24(29)25(30)12-18)32-26(20)19-6-3-2-4-7-19/h2-14,16H,15H2,1H3/b23-13+
InChIKey QAAVTEKVRMOABW-YDZHTSKRSA-N
Molecular Weight 521.835 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_968
Solvent DMSO-d6
Source Vendor ID: ZI/8121136; Lab Info: SAD; Lab Number: SAD-1500163