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2(1H)-pyrimidinone, 5-(4-chlorobenzoyl)tetrahydro-4-hydroxy-6-[4-(1-methylethyl)phenyl]-4-(trifluoromethyl)-
SpectraBase Compound ID DbqyT3RPL2R
InChI InChI=1S/C21H20ClF3N2O3/c1-11(2)12-3-5-13(6-4-12)17-16(18(28)14-7-9-15(22)10-8-14)20(30,21(23,24)25)27-19(29)26-17/h3-11,16-17,30H,1-2H3,(H2,26,27,29)
InChIKey GUXHSSDEXOEKQB-UHFFFAOYSA-N
Mol Weight 440.85 g/mol
Molecular Formula C21H20ClF3N2O3
Exact Mass 440.111455 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID npn2yMOBCY
Name 2(1H)-pyrimidinone, 5-(4-chlorobenzoyl)tetrahydro-4-hydroxy-6-[4-(1-methylethyl)phenyl]-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/C21H20ClF3N2O3/c1-11(2)12-3-5-13(6-4-12)17-16(18(28)14-7-9-15(22)10-8-14)20(30,21(23,24)25)27-19(29)26-17/h3-11,16-17,30H,1-2H3,(H2,26,27,29)
InChIKey GUXHSSDEXOEKQB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2870
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/11248414