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2-[4-chloro-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]-4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidine

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2-[4-chloro-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]-4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidine
SpectraBase Compound ID ATx25Tz5OT0
InChI InChI=1S/C28H19Cl2F3N4/c1-16-3-7-19(8-4-16)25-24(30)26(20-9-5-17(2)6-10-20)37(36-25)27-34-22(15-23(35-27)28(31,32)33)18-11-13-21(29)14-12-18/h3-15H,1-2H3
InChIKey XOMPGUSPDLMEQL-UHFFFAOYSA-N
Mol Weight 539.39 g/mol
Molecular Formula C28H19Cl2F3N4
Exact Mass 538.093887 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6rPUfgEe4r2
Name 2-[4-chloro-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]-4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C28H19Cl2F3N4/c1-16-3-7-19(8-4-16)25-24(30)26(20-9-5-17(2)6-10-20)37(36-25)27-34-22(15-23(35-27)28(31,32)33)18-11-13-21(29)14-12-18/h3-15H,1-2H3
InChIKey XOMPGUSPDLMEQL-UHFFFAOYSA-N
NMR Offset 17.9118
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31327
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1766688; SBI_ID: SBI-031331
Temperature 303 °C