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1-[(4-methylphenyl)sulfonyl]-4-(2,3,4-trimethoxybenzyl)piperazine
SpectraBase Compound ID 9zktOOU0l17
InChI InChI=1S/C21H28N2O5S/c1-16-5-8-18(9-6-16)29(24,25)23-13-11-22(12-14-23)15-17-7-10-19(26-2)21(28-4)20(17)27-3/h5-10H,11-15H2,1-4H3
InChIKey JKUZPKGXDBYTIB-UHFFFAOYSA-N
Mol Weight 420.52 g/mol
Molecular Formula C21H28N2O5S
Exact Mass 420.171893 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7S8trZGRRMF
Name 1-[(4-methylphenyl)sulfonyl]-4-(2,3,4-trimethoxybenzyl)piperazine
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/C21H28N2O5S/c1-16-5-8-18(9-6-16)29(24,25)23-13-11-22(12-14-23)15-17-7-10-19(26-2)21(28-4)20(17)27-3/h5-10H,11-15H2,1-4H3
InChIKey JKUZPKGXDBYTIB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20534
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: UZI/9181758; UBI_ID: UBI-020538
Temperature 308 °C