4-bromo-3,5-bis(3,4-dimethylphenyl)-1-[3-(trifluoromethyl)benzyl]-1H-pyrazole

SpectraBase Compound ID	G2Y41DnaWEC
InChI	InChI=1S/C27H24BrF3N2/c1-16-8-10-21(12-18(16)3)25-24(28)26(22-11-9-17(2)19(4)13-22)33(32-25)15-20-6-5-7-23(14-20)27(29,30)31/h5-14H,15H2,1-4H3
InChIKey	MMKDSRQAYVPSCP-UHFFFAOYSA-N Google Search
Mol Weight	513.4 g/mol
Molecular Formula	C27H24BrF3N2
Exact Mass	512.107496 g/mol

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SpectraBase Spectrum ID	7jijyjQKnu6
Name	4-bromo-3,5-bis(3,4-dimethylphenyl)-1-[3-(trifluoromethyl)benzyl]-1H-pyrazole
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/C27H24BrF3N2/c1-16-8-10-21(12-18(16)3)25-24(28)26(22-11-9-17(2)19(4)13-22)33(32-25)15-20-6-5-7-23(14-20)27(29,30)31/h5-14H,15H2,1-4H3
InChIKey	MMKDSRQAYVPSCP-UHFFFAOYSA-N
NMR Offset	17.9118
NMR Spectrometer Frequency	500.077
Observed nucleus	1H
Origin	1H_SBI_36227_30609
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: 1721464; SBI_ID: SBI-030613
Temperature	303 °C