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ethanone, 1-[4-[4-(2-chloro-4,5-difluorobenzoyl)-1-piperazinyl]-5-fluoro-2-methylphenyl]-
SpectraBase Compound ID CzMKm51tQi3
InChI InChI=1S/C20H18ClF3N2O2/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 HVNWHNNEWLCGDW-UHFFFAOYSA-N
Mol Weight 410.82 g/mol
Molecular Formula C20H18ClF3N2O2
Exact Mass 410.10089 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HInRKZlpHFG
Name ethanone, 1-[4-[4-(2-chloro-4,5-difluorobenzoyl)-1-piperazinyl]-5-fluoro-2-methylphenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.100890015 u
Formula C20H18ClF3N2O2
InChI InChI=1S/C20H18ClF3N2O2/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 HVNWHNNEWLCGDW-UHFFFAOYSA-N
Molecular Weight 410.824 g/mol
NMR Offset 16.579
NMR Spectrometer Frequency 250.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_239
Solvent DMSO-d6
Source Vendor ID: ZI/8080257; Lab Info: L-05,Kirsanova; Lab Number: L-05/0000694
Temperature 23.85 °C