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4-thiazolidinone, 5-[[2-[2-(3-ethyl-5-methylphenoxy)ethoxy]-5-nitrophenyl]methylene]-3-methyl-2-thioxo-, (5E)-
SpectraBase Compound ID AnELE3pNYeb
InChI InChI=1S/C22H22N2O5S2/c1-4-15-9-14(2)10-18(11-15)28-7-8-29-19-6-5-17(24(26)27)12-16(19)13-20-21(25)23(3)22(30)31-20/h5-6,9-13H,4,7-8H2,1-3H3/b20-13+
InChIKey AUHIJTPNSCHMRX-DEDYPNTBSA-N
Mol Weight 458.55 g/mol
Molecular Formula C22H22N2O5S2
Exact Mass 458.097014 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I8YEZmhiFth
Name 4-thiazolidinone, 5-[[2-[2-(3-ethyl-5-methylphenoxy)ethoxy]-5-nitrophenyl]methylene]-3-methyl-2-thioxo-, (5E)-
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/C22H22N2O5S2/c1-4-15-9-14(2)10-18(11-15)28-7-8-29-19-6-5-17(24(26)27)12-16(19)13-20-21(25)23(3)22(30)31-20/h5-6,9-13H,4,7-8H2,1-3H3/b20-13+
InChIKey AUHIJTPNSCHMRX-DEDYPNTBSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6843
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/10278991