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

View entire compound with spectra: 1 NMR

methyl [2-allyl-4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)-6-ethoxyphenoxy]acetate
SpectraBase Compound ID 7t28igFvPPW
InChI InChI=1S/C27H28N2O7S/c1-5-7-19-12-18(13-21(35-6-2)25(19)36-16-24(31)34-4)14-22-26(32)29(27(33)37-22)15-23(30)28-20-10-8-17(3)9-11-20/h5,8-14H,1,6-7,15-16H2,2-4H3,(H,28,30)/b22-14+
InChIKey MMJFLSPZWBGAQT-HYARGMPZSA-N
Mol Weight 524.59 g/mol
Molecular Formula C27H28N2O7S
Exact Mass 524.161722 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cl5zx6VS3iq
Name methyl [2-allyl-4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)-6-ethoxyphenoxy]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/C27H28N2O7S/c1-5-7-19-12-18(13-21(35-6-2)25(19)36-16-24(31)34-4)14-22-26(32)29(27(33)37-22)15-23(30)28-20-10-8-17(3)9-11-20/h5,8-14H,1,6-7,15-16H2,2-4H3,(H,28,30)/b22-14+
InChIKey MMJFLSPZWBGAQT-HYARGMPZSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11557
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: 1003309; UBI_ID: UBI-011560
Synonyms methyl [2-allyl-4-({2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)-6-ethoxyphenoxy]acetate
Temperature 308 °C