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1-((2-nitrophenyl)sulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine oxalate

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1-((2-nitrophenyl)sulfonyl)-4-(3,4,5-trimethoxybenzyl)piperazine oxalate
SpectraBase Compound ID F8q6MDped1P
InChI InChI=1S/C20H25N3O7S.C2H2O4/c1-28-17-12-15(13-18(29-2)20(17)30-3)14-21-8-10-22(11-9-21)31(26,27)19-7-5-4-6-16(19)23(24)25;3-1(4)2(5)6/h4-7,12-13H,8-11,14H2,1-3H3;(H,3,4)(H,5,6)
InChIKey ZFVKFAAPDFAJRB-UHFFFAOYSA-N
Mol Weight 541.53 g/mol
Molecular Formula C22H27N3O11S
Exact Mass 541.13663 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HIYxiz5uWCq
Name 1-((2-nitrophenyl)sulfonyl)-4-(3,4,5-trimethoxybenzyl)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/C20H25N3O7S.C2H2O4/c1-28-17-12-15(13-18(29-2)20(17)30-3)14-21-8-10-22(11-9-21)31(26,27)19-7-5-4-6-16(19)23(24)25;3-1(4)2(5)6/h4-7,12-13H,8-11,14H2,1-3H3;(H,3,4)(H,5,6)
InChIKey ZFVKFAAPDFAJRB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2797
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/11269574