1-[4-[4-(2-Bromo-benzoyl)-piperazin-1-yl]-3-fluoro-phenyl]-butan-1-one

SpectraBase Compound ID	IPfUwXenVlj
InChI	InChI=1S/C21H22BrFN2O2/c1-2-5-20(26)15-8-9-19(18(23)14-15)24-10-12-25(13-11-24)21(27)16-6-3-4-7-17(16)22/h3-4,6-9,14H,2,5,10-13H2,1H3
InChIKey	SNEUCIJXPGWCJU-UHFFFAOYSA-N Google Search
Mol Weight	433.32 g/mol
Molecular Formula	C21H22BrFN2O2
Exact Mass	432.084869 g/mol

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SpectraBase Spectrum ID	Fq5vJpz4hbM
Name	1-butanone, 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	432.084869117 u
Formula	C21H22BrFN2O2
InChI	InChI=1S/C21H22BrFN2O2/c1-2-5-20(26)15-8-9-19(18(23)14-15)24-10-12-25(13-11-24)21(27)16-6-3-4-7-17(16)22/h3-4,6-9,14H,2,5,10-13H2,1H3
InChIKey	SNEUCIJXPGWCJU-UHFFFAOYSA-N
Molecular Weight	433.321 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_12052
Solvent	DMSO-d6
Source	Vendor ID: NMR/10271838; Lab Info: LIP; Lab Number: LIP-0001556