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

*Links on SpectraBase are not permalinks.
4-chloro-N-{4-[4-(methylsulfonyl)-1-piperazinyl]phenyl}-3-nitrobenzamide
SpectraBase Compound ID 2i5nGTdJcUO
InChI InChI=1S/C18H19ClN4O5S/c1-29(27,28)22-10-8-21(9-11-22)15-5-3-14(4-6-15)20-18(24)13-2-7-16(19)17(12-13)23(25)26/h2-7,12H,8-11H2,1H3,(H,20,24)
InChIKey MXJSKIBKVFSWBG-UHFFFAOYSA-N
Mol Weight 438.89 g/mol
Molecular Formula C18H19ClN4O5S
Exact Mass 438.076469 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 Jxc9SYesUG9
Name 4-chloro-N-{4-[4-(methylsulfonyl)-1-piperazinyl]phenyl}-3-nitrobenzamide
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/C18H19ClN4O5S/c1-29(27,28)22-10-8-21(9-11-22)15-5-3-14(4-6-15)20-18(24)13-2-7-16(19)17(12-13)23(25)26/h2-7,12H,8-11H2,1H3,(H,20,24)
InChIKey MXJSKIBKVFSWBG-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35060
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: E83313; SBI_ID: SBI-035064
Temperature 298 °C