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

*Links on SpectraBase are not permalinks.
3-isothiazolidinone, 2-[4-ethoxy-3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]phenyl]-, 1,1-dioxide
SpectraBase Compound ID DMTuQAxK5Tn
InChI InChI=1S/C19H23N5O6S2/c1-2-30-16-5-4-15(24-18(25)6-13-31(24,26)27)14-17(16)32(28,29)23-11-9-22(10-12-23)19-20-7-3-8-21-19/h3-5,7-8,14H,2,6,9-13H2,1H3
InChIKey LXPGQFJCWHLMCM-UHFFFAOYSA-N
Mol Weight 481.54 g/mol
Molecular Formula C19H23N5O6S2
Exact Mass 481.108976 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 KZkgLlIK6JO
Name 3-isothiazolidinone, 2-[4-ethoxy-3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]phenyl]-, 1,1-dioxide
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/C19H23N5O6S2/c1-2-30-16-5-4-15(24-18(25)6-13-31(24,26)27)14-17(16)32(28,29)23-11-9-22(10-12-23)19-20-7-3-8-21-19/h3-5,7-8,14H,2,6,9-13H2,1H3
InChIKey LXPGQFJCWHLMCM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9432
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: F35383; Labnumber: CHEKAN-00813