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1-(3-Fluoro-4-[4-(phenylsulfonyl)-1-piperazinyl]phenyl)-1-butanone
SpectraBase Compound ID 6sufEacIQQd
InChI InChI=1S/C20H23FN2O3S/c1-2-6-20(24)16-9-10-19(18(21)15-16)22-11-13-23(14-12-22)27(25,26)17-7-4-3-5-8-17/h3-5,7-10,15H,2,6,11-14H2,1H3
InChIKey BWRFYUFVNHYVJN-UHFFFAOYSA-N
Mol Weight 390.47 g/mol
Molecular Formula C20H23FN2O3S
Exact Mass 390.141342 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IIZtEEck4Kh
Name 1-butanone, 1-[3-fluoro-4-[4-(phenylsulfonyl)-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 390.141341943 u
Formula C20H23FN2O3S
InChI InChI=1S/C20H23FN2O3S/c1-2-6-20(24)16-9-10-19(18(21)15-16)22-11-13-23(14-12-22)27(25,26)17-7-4-3-5-8-17/h3-5,7-10,15H,2,6,11-14H2,1H3
InChIKey BWRFYUFVNHYVJN-UHFFFAOYSA-N
Molecular Weight 390.473 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11702
Solvent DMSO-d6
Source Vendor ID: NMR/10271326; Lab Info: LIP; Lab Number: LIP-0000008