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ethanone, 1-[4-[4-(2-bromo-4,5-difluorobenzoyl)-1-piperazinyl]-5-fluoro-2-methylphenyl]-
SpectraBase Compound ID 99mJWSFyyMD
InChI InChI=1S/C20H18BrF3N2O2/c1-11-7-19(18(24)8-13(11)12(2)27)25-3-5-26(6-4-25)20(28)14-9-16(22)17(23)10-15(14)21/h7-10H,3-6H2,1-2H3
InChIKey JGEQXMNYOZZVKT-UHFFFAOYSA-N
Mol Weight 455.28 g/mol
Molecular Formula C20H18BrF3N2O2
Exact Mass 454.050375 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1IFHp7CthJa
Name ethanone, 1-[4-[4-(2-bromo-4,5-difluorobenzoyl)-1-piperazinyl]-5-fluoro-2-methylphenyl]-
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/C20H18BrF3N2O2/c1-11-7-19(18(24)8-13(11)12(2)27)25-3-5-26(6-4-25)20(28)14-9-16(22)17(23)10-15(14)21/h7-10H,3-6H2,1-2H3
InChIKey JGEQXMNYOZZVKT-UHFFFAOYSA-N
NMR Offset 16.579
NMR Spectrometer Frequency 250.133
Observed nucleus 1H
Origin 1H_CB_8313_1573
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: NMR/9211643; Labnumber: L-05,Lipkind
Temperature 297 °C