2(1H)-pyrimidinone, 6-[4-(1,1-dimethylethyl)phenyl]-5-(4-fluorobenzoyl)tetrahydro-4-hydroxy-4-(trifluoromethyl)-

SpectraBase Compound ID	9u36lSxw0rJ
InChI	InChI=1S/C22H22F4N2O3/c1-20(2,3)14-8-4-12(5-9-14)17-16(18(29)13-6-10-15(23)11-7-13)21(31,22(24,25)26)28-19(30)27-17/h4-11,16-17,31H,1-3H3,(H2,27,28,30)
InChIKey	APDVGRBZNXOVEU-UHFFFAOYSA-N Google Search
Mol Weight	438.42 g/mol
Molecular Formula	C22H22F4N2O3
Exact Mass	438.156655 g/mol

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SpectraBase Spectrum ID	KtWf0XKLCO5
Name	2(1H)-pyrimidinone, 6-[4-(1,1-dimethylethyl)phenyl]-5-(4-fluorobenzoyl)tetrahydro-4-hydroxy-4-(trifluoromethyl)-
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/C22H22F4N2O3/c1-20(2,3)14-8-4-12(5-9-14)17-16(18(29)13-6-10-15(23)11-7-13)21(31,22(24,25)26)28-19(30)27-17/h4-11,16-17,31H,1-3H3,(H2,27,28,30)
InChIKey	APDVGRBZNXOVEU-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_3517_2887
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: NMR/11248434