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methyl 4-{[4-(4-nitrobenzyl)-1-piperazinyl]sulfonyl}phenyl ether
SpectraBase Compound ID AMKVi1pEgiI
InChI InChI=1S/C18H21N3O5S/c1-26-17-6-8-18(9-7-17)27(24,25)20-12-10-19(11-13-20)14-15-2-4-16(5-3-15)21(22)23/h2-9H,10-14H2,1H3
InChIKey AVWIDQJQZNROAN-UHFFFAOYSA-N
Mol Weight 391.44 g/mol
Molecular Formula C18H21N3O5S
Exact Mass 391.120192 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LT22LYEndzM
Name methyl 4-{[4-(4-nitrobenzyl)-1-piperazinyl]sulfonyl}phenyl ether
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/C18H21N3O5S/c1-26-17-6-8-18(9-7-17)27(24,25)20-12-10-19(11-13-20)14-15-2-4-16(5-3-15)21(22)23/h2-9H,10-14H2,1H3
InChIKey AVWIDQJQZNROAN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13761
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/9312018; UBI_ID: UBI-013764
Synonyms 1-[(4-methoxyphenyl)sulfonyl]-4-(4-nitrobenzyl)piperazine
Temperature 308 °C