For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-(4-Benzenesulfonyl-piperazin-1-yl)-2-chloro-5-fluoro-benzonitrile

View entire compound with spectra: 2 NMR, and 1 MS (GC)

4-(4-Benzenesulfonyl-piperazin-1-yl)-2-chloro-5-fluoro-benzonitrile
SpectraBase Compound ID JHfk6WiaSVY
InChI InChI=1S/C17H15ClFN3O2S/c18-15-11-17(16(19)10-13(15)12-20)21-6-8-22(9-7-21)25(23,24)14-4-2-1-3-5-14/h1-5,10-11H,6-9H2
InChIKey DVBTXHYTOANGLI-UHFFFAOYSA-N
Mol Weight 379.84 g/mol
Molecular Formula C17H15ClFN3O2S
Exact Mass 379.055754 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BOvyzuRgD4b
Name 2-chloro-5-fluoro-4-[4-(phenylsulfonyl)-1-piperazinyl]benzonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H15ClFN3O2S/c18-15-11-17(16(19)10-13(15)12-20)21-6-8-22(9-7-21)25(23,24)14-4-2-1-3-5-14/h1-5,10-11H,6-9H2
InChIKey DVBTXHYTOANGLI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5227
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11211167; Labnumber: LIP-0001660; IOH_ID: IOH-005228