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1-(4-(benzyloxy)-3-methoxybenzyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate

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1-(4-(benzyloxy)-3-methoxybenzyl)-4-((2-nitrophenyl)sulfonyl)piperazine oxalate
SpectraBase Compound ID 4YDucv7Dzp6
InChI InChI=1S/C25H27N3O6S.C2H2O4/c1-33-24-17-21(11-12-23(24)34-19-20-7-3-2-4-8-20)18-26-13-15-27(16-14-26)35(31,32)25-10-6-5-9-22(25)28(29)30;3-1(4)2(5)6/h2-12,17H,13-16,18-19H2,1H3;(H,3,4)(H,5,6)
InChIKey XZALUIPCGCNNHI-UHFFFAOYSA-N
Mol Weight 587.6 g/mol
Molecular Formula C27H29N3O10S
Exact Mass 587.157365 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I9TJWtirDZQ
Name 1-(4-(benzyloxy)-3-methoxybenzyl)-4-((2-nitrophenyl)sulfonyl)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/C25H27N3O6S.C2H2O4/c1-33-24-17-21(11-12-23(24)34-19-20-7-3-2-4-8-20)18-26-13-15-27(16-14-26)35(31,32)25-10-6-5-9-22(25)28(29)30;3-1(4)2(5)6/h2-12,17H,13-16,18-19H2,1H3;(H,3,4)(H,5,6)
InChIKey XZALUIPCGCNNHI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3018
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/11269833