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1-((4-chlorophenyl)sulfonyl)-4-(4-(methylthio)benzyl)piperazine oxalate

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1-((4-chlorophenyl)sulfonyl)-4-(4-(methylthio)benzyl)piperazine oxalate
SpectraBase Compound ID 6FAYkAQPeqN
InChI InChI=1S/C18H21ClN2O2S2.C2H2O4/c1-24-17-6-2-15(3-7-17)14-20-10-12-21(13-11-20)25(22,23)18-8-4-16(19)5-9-18;3-1(4)2(5)6/h2-9H,10-14H2,1H3;(H,3,4)(H,5,6)
InChIKey ZKVMMSASSYZGQI-UHFFFAOYSA-N
Mol Weight 486.99 g/mol
Molecular Formula C20H23ClN2O6S2
Exact Mass 486.068607 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 616gwZTZzKw
Name 1-((4-chlorophenyl)sulfonyl)-4-(4-(methylthio)benzyl)piperazine oxalate
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/C18H21ClN2O2S2.C2H2O4/c1-24-17-6-2-15(3-7-17)14-20-10-12-21(13-11-20)25(22,23)18-8-4-16(19)5-9-18;3-1(4)2(5)6/h2-9H,10-14H2,1H3;(H,3,4)(H,5,6)
InChIKey ZKVMMSASSYZGQI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2895
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/11269703