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N-[2-[4-(2-chloro-6-fluoro-benzyl)piperazino]ethyl]-N'-(4-fluorophenyl)oxamide
SpectraBase Compound ID JYnaDz0USxM
InChI InChI=1S/C21H23ClF2N4O2/c22-18-2-1-3-19(24)17(18)14-28-12-10-27(11-13-28)9-8-25-20(29)21(30)26-16-6-4-15(23)5-7-16/h1-7H,8-14H2,(H,25,29)(H,26,30)
InChIKey JQRJWTJMWLINMJ-UHFFFAOYSA-N
Mol Weight 436.89 g/mol
Molecular Formula C21H23ClF2N4O2
Exact Mass 436.14776 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9C0fXDZxmom
Name ethanediamide, N~1~-[2-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]ethyl]-N~2~-(4-fluorophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.147760021 u
Formula C21H23ClF2N4O2
InChI InChI=1S/C21H23ClF2N4O2/c22-18-2-1-3-19(24)17(18)14-28-12-10-27(11-13-28)9-8-25-20(29)21(30)26-16-6-4-15(23)5-7-16/h1-7H,8-14H2,(H,25,29)(H,26,30)
InChIKey JQRJWTJMWLINMJ-UHFFFAOYSA-N
Molecular Weight 436.891 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7891
Solvent DMSO-d6
Source Vendor ID: NMR/10240161; Lab Info: LP; Lab Number: LP-0201399