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1-[4-[4-(2-Bromo-benzoyl)-piperazin-1-yl]-3-fluoro-phenyl]-propan-1-one
SpectraBase Compound ID EegE2HTDefA
InChI InChI=1S/C20H20BrFN2O2/c1-2-19(25)14-7-8-18(17(22)13-14)23-9-11-24(12-10-23)20(26)15-5-3-4-6-16(15)21/h3-8,13H,2,9-12H2,1H3
InChIKey GCOXQBBUHWDHRI-UHFFFAOYSA-N
Mol Weight 419.29 g/mol
Molecular Formula C20H20BrFN2O2
Exact Mass 418.069219 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fn8IpP665s9
Name 1-propanone, 1-[4-[4-(2-bromobenzoyl)-1-piperazinyl]-3-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 418.069219053 u
Formula C20H20BrFN2O2
InChI InChI=1S/C20H20BrFN2O2/c1-2-19(25)14-7-8-18(17(22)13-14)23-9-11-24(12-10-23)20(26)15-5-3-4-6-16(15)21/h3-8,13H,2,9-12H2,1H3
InChIKey GCOXQBBUHWDHRI-UHFFFAOYSA-N
Molecular Weight 419.294 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11424
Solvent DMSO-d6
Source Vendor ID: NMR/10261175; Lab Info: LIP; Lab Number: 14