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3-thiophenecarboxylic acid, 2-[[(4-chlorophenyl)acetyl]amino]-5-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]carbonyl]-4-methyl-, ethyl ester

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3-thiophenecarboxylic acid, 2-[[(4-chlorophenyl)acetyl]amino]-5-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]carbonyl]-4-methyl-, ethyl ester
SpectraBase Compound ID mWAPcTCzuB
InChI InChI=1S/C24H19Cl2F3N2O4S/c1-3-35-23(34)19-12(2)20(21(33)30-17-11-14(24(27,28)29)6-9-16(17)26)36-22(19)31-18(32)10-13-4-7-15(25)8-5-13/h4-9,11H,3,10H2,1-2H3,(H,30,33)(H,31,32)
InChIKey HFGRCSKPMUFWPN-UHFFFAOYSA-N
Mol Weight 559.39 g/mol
Molecular Formula C24H19Cl2F3N2O4S
Exact Mass 558.039468 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CTFQ2feOdNS
Name 3-thiophenecarboxylic acid, 2-[[(4-chlorophenyl)acetyl]amino]-5-[[[2-chloro-5-(trifluoromethyl)phenyl]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 558.039468159 u
Formula C24H19Cl2F3N2O4S
InChI InChI=1S/C24H19Cl2F3N2O4S/c1-3-35-23(34)19-12(2)20(21(33)30-17-11-14(24(27,28)29)6-9-16(17)26)36-22(19)31-18(32)10-13-4-7-15(25)8-5-13/h4-9,11H,3,10H2,1-2H3,(H,30,33)(H,31,32)
InChIKey HFGRCSKPMUFWPN-UHFFFAOYSA-N
Molecular Weight 559.387 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8054
Solvent DMSO-d6
Source Vendor ID: NMR/9290447; Lab Info: SAS; Lab Number: SAS-TST2842
Temperature 29.85 °C