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3-thiophenecarboxylic acid, 5-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]carbonyl]-4-methyl-2-[(phenoxyacetyl)amino]-,
SpectraBase Compound ID IGIl80qhzUC
InChI InChI=1S/C24H20ClF3N2O5S/c1-3-34-23(33)19-13(2)20(21(32)29-17-11-14(24(26,27)28)9-10-16(17)25)36-22(19)30-18(31)12-35-15-7-5-4-6-8-15/h4-11H,3,12H2,1-2H3,(H,29,32)(H,30,31)
InChIKey FFYYNJLINGBFAY-UHFFFAOYSA-N
Mol Weight 540.94 g/mol
Molecular Formula C24H20ClF3N2O5S
Exact Mass 540.073355 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4jALuPvEHcT
Name 3-thiophenecarboxylic acid, 5-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]carbonyl]-4-methyl-2-[(phenoxyacetyl)amino]-,
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 540.073355110 u
Formula C24H20ClF3N2O5S
InChI InChI=1S/C24H20ClF3N2O5S/c1-3-34-23(33)19-13(2)20(21(32)29-17-11-14(24(26,27)28)9-10-16(17)25)36-22(19)30-18(31)12-35-15-7-5-4-6-8-15/h4-11H,3,12H2,1-2H3,(H,29,32)(H,30,31)
InChIKey FFYYNJLINGBFAY-UHFFFAOYSA-N
Molecular Weight 540.941 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8059
Solvent DMSO-d6
Source Vendor ID: NMR/9290489; Lab Info: SAS; Lab Number: SAS-TST2884
Temperature 23.85 °C