ethyl 1,4-bis[(4-methylphenyl)sulfonyl]-2-piperazinecarboxylate

SpectraBase Compound ID	5cfaj6AFf11
InChI	InChI=1S/C21H26N2O6S2/c1-4-29-21(24)20-15-22(30(25,26)18-9-5-16(2)6-10-18)13-14-23(20)31(27,28)19-11-7-17(3)8-12-19/h5-12,20H,4,13-15H2,1-3H3
InChIKey	NOUSMLMZKBDRAG-UHFFFAOYSA-N Google Search
Mol Weight	466.57 g/mol
Molecular Formula	C21H26N2O6S2
Exact Mass	466.123229 g/mol

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SpectraBase Spectrum ID	Ki910ScU5mA
Name	ethyl 1,4-bis[(4-methylphenyl)sulfonyl]-2-piperazinecarboxylate
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/C21H26N2O6S2/c1-4-29-21(24)20-15-22(30(25,26)18-9-5-16(2)6-10-18)13-14-23(20)31(27,28)19-11-7-17(3)8-12-19/h5-12,20H,4,13-15H2,1-3H3
InChIKey	NOUSMLMZKBDRAG-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5765
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/11231486; Labnumber: LP-2110419; IOH_ID: IOH-005766