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4-{5-[4-(2-chloro-4,5-difluorobenzoyl)-1-piperazinyl]-2-fluoro-4-nitrophenyl}morpholine
SpectraBase Compound ID 6UAAYDKnDLG
InChI InChI=1S/C21H20ClF3N4O4/c22-14-10-16(24)15(23)9-13(14)21(30)28-3-1-26(2-4-28)19-12-18(27-5-7-33-8-6-27)17(25)11-20(19)29(31)32/h9-12H,1-8H2
InChIKey SXTZMVKECAUMJG-UHFFFAOYSA-N
Mol Weight 484.86 g/mol
Molecular Formula C21H20ClF3N4O4
Exact Mass 484.112517 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D226T3jQ8HU
Name 4-{5-[4-(2-chloro-4,5-difluorobenzoyl)-1-piperazinyl]-2-fluoro-4-nitrophenyl}morpholine
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/C21H20ClF3N4O4/c22-14-10-16(24)15(23)9-13(14)21(30)28-3-1-26(2-4-28)19-12-18(27-5-7-33-8-6-27)17(25)11-20(19)29(31)32/h9-12H,1-8H2
InChIKey SXTZMVKECAUMJG-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5225
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/11211164; Labnumber: LIP-0001656; IOH_ID: IOH-005226