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1-[3-Fluoro-4-[4-(4-fluoro-benzoyl)-piperazin-1-yl]-phenyl]-butan-1-one
SpectraBase Compound ID HCwkN3czxYv
InChI InChI=1S/C21H22F2N2O2/c1-2-3-20(26)16-6-9-19(18(23)14-16)24-10-12-25(13-11-24)21(27)15-4-7-17(22)8-5-15/h4-9,14H,2-3,10-13H2,1H3
InChIKey AGYRXMIQSFOOAU-UHFFFAOYSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H22F2N2O2
Exact Mass 372.164934 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FjF6yALLmTG
Name 1-butanone, 1-[3-fluoro-4-[4-(4-fluorobenzoyl)-1-piperazinyl]phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.164934280 u
Formula C21H22F2N2O2
InChI InChI=1S/C21H22F2N2O2/c1-2-3-20(26)16-6-9-19(18(23)14-16)24-10-12-25(13-11-24)21(27)15-4-7-17(22)8-5-15/h4-9,14H,2-3,10-13H2,1H3
InChIKey AGYRXMIQSFOOAU-UHFFFAOYSA-N
Molecular Weight 372.416 g/mol
NMR Offset 17.7209
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13307
Solvent CDCl3
Source Vendor ID: NMR/10240692; Lab Info: L-05; Lab Number: LIP-0001365