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methyl [2-chloro-4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)-6-methoxyphenoxy]acetate

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methyl [2-chloro-4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)-6-methoxyphenoxy]acetate
SpectraBase Compound ID JEz6pek9SQ4
InChI InChI=1S/C23H21ClN2O7S/c1-13-4-6-15(7-5-13)25-19(27)11-26-22(29)18(34-23(26)30)10-14-8-16(24)21(17(9-14)31-2)33-12-20(28)32-3/h4-10H,11-12H2,1-3H3,(H,25,27)/b18-10+
InChIKey BARWTURYWRLQGB-VCHYOVAHSA-N
Mol Weight 504.94 g/mol
Molecular Formula C23H21ClN2O7S
Exact Mass 504.0758 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BrA19KzF5Kj
Name methyl [2-chloro-4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)-6-methoxyphenoxy]acetate
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/C23H21ClN2O7S/c1-13-4-6-15(7-5-13)25-19(27)11-26-22(29)18(34-23(26)30)10-14-8-16(24)21(17(9-14)31-2)33-12-20(28)32-3/h4-10H,11-12H2,1-3H3,(H,25,27)/b18-10+
InChIKey BARWTURYWRLQGB-VCHYOVAHSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11548
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: 1002886; UBI_ID: UBI-011551
Synonyms methyl [2-chloro-4-({2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)-6-methoxyphenoxy]acetate
Temperature 318 °C