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2(1H)-pyrimidinone, 5-(4-bromobenzoyl)-6-[5-(3-chlorophenyl)-2-furanyl]tetrahydro-4-hydroxy-4-(trifluoromethyl)-
SpectraBase Compound ID 9EqdUwfY2pZ
InChI InChI=1S/C22H15BrClF3N2O4/c23-13-6-4-11(5-7-13)19(30)17-18(28-20(31)29-21(17,32)22(25,26)27)16-9-8-15(33-16)12-2-1-3-14(24)10-12/h1-10,17-18,32H,(H2,28,29,31)
InChIKey CZKTYPOIXMVYQB-UHFFFAOYSA-N
Mol Weight 543.72 g/mol
Molecular Formula C22H15BrClF3N2O4
Exact Mass 541.985582 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dz3HCtSm5gn
Name 2(1H)-pyrimidinone, 5-(4-bromobenzoyl)-6-[5-(3-chlorophenyl)-2-furanyl]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/C22H15BrClF3N2O4/c23-13-6-4-11(5-7-13)19(30)17-18(28-20(31)29-21(17,32)22(25,26)27)16-9-8-15(33-16)12-2-1-3-14(24)10-12/h1-10,17-18,32H,(H2,28,29,31)
InChIKey CZKTYPOIXMVYQB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_3387
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/11249110