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2-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]-5-[(2,4-dimethoxyanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester

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2-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]-5-[(2,4-dimethoxyanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester
SpectraBase Compound ID Ll3qqpjxU6K
InChI InChI=1S/C25H25ClN2O7S/c1-5-34-25(31)21-14(2)22(23(30)27-18-11-10-17(32-3)12-19(18)33-4)36-24(21)28-20(29)13-35-16-8-6-15(26)7-9-16/h6-12H,5,13H2,1-4H3,(H,27,30)(H,28,29)
InChIKey KJEHDXHQIUTSAD-UHFFFAOYSA-N
Mol Weight 533.0 g/mol
Molecular Formula C25H25ClN2O7S
Exact Mass 532.1071 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FNnFUEDh6Sm
Name 3-thiophenecarboxylic acid, 2-[[(4-chlorophenoxy)acetyl]amino]-5-[[(2,4-dimethoxyphenyl)amino]carbonyl]-4-methyl-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 532.107100020 u
Formula C25H25ClN2O7S
InChI InChI=1S/C25H25ClN2O7S/c1-5-34-25(31)21-14(2)22(23(30)27-18-11-10-17(32-3)12-19(18)33-4)36-24(21)28-20(29)13-35-16-8-6-15(26)7-9-16/h6-12H,5,13H2,1-4H3,(H,27,30)(H,28,29)
InChIKey KJEHDXHQIUTSAD-UHFFFAOYSA-N
Molecular Weight 532.995 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5137
Solvent DMSO-d6
Source Vendor ID: NMR/9302632; Lab Info: SAS; Lab Number: SAS-tst3070