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1-(4-(methylthio)benzyl)-4-(propylsulfonyl)piperazine oxalate

View entire compound with spectra: 1 NMR

1-(4-(methylthio)benzyl)-4-(propylsulfonyl)piperazine oxalate
SpectraBase Compound ID 4N9rtVnVPyV
InChI InChI=1S/C15H24N2O2S2.C2H2O4/c1-3-12-21(18,19)17-10-8-16(9-11-17)13-14-4-6-15(20-2)7-5-14;3-1(4)2(5)6/h4-7H,3,8-13H2,1-2H3;(H,3,4)(H,5,6)
InChIKey VCQCMBMKLLXFOU-UHFFFAOYSA-N
Mol Weight 418.52 g/mol
Molecular Formula C17H26N2O6S2
Exact Mass 418.123229 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HCQtkhWxzpa
Name 1-(4-(methylthio)benzyl)-4-(propylsulfonyl)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/C15H24N2O2S2.C2H2O4/c1-3-12-21(18,19)17-10-8-16(9-11-17)13-14-4-6-15(20-2)7-5-14;3-1(4)2(5)6/h4-7H,3,8-13H2,1-2H3;(H,3,4)(H,5,6)
InChIKey VCQCMBMKLLXFOU-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2858
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/11269664