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2-thiophenecarboxylic acid, 3-[[[(2-chlorophenyl)amino]carbonyl]amino]-5-(4-ethoxyphenyl)-, methyl ester
SpectraBase Compound ID BmnVxb8uFGY
InChI InChI=1S/C21H19ClN2O4S/c1-3-28-14-10-8-13(9-11-14)18-12-17(19(29-18)20(25)27-2)24-21(26)23-16-7-5-4-6-15(16)22/h4-12H,3H2,1-2H3,(H2,23,24,26)
InChIKey MLSCYUHWICRRFM-UHFFFAOYSA-N
Mol Weight 430.91 g/mol
Molecular Formula C21H19ClN2O4S
Exact Mass 430.075406 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bz6ziCO2ebb
Name 2-thiophenecarboxylic acid, 3-[[[(2-chlorophenyl)amino]carbonyl]amino]-5-(4-ethoxyphenyl)-, methyl 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 430.075405970 u
Formula C21H19ClN2O4S
InChI InChI=1S/C21H19ClN2O4S/c1-3-28-14-10-8-13(9-11-14)18-12-17(19(29-18)20(25)27-2)24-21(26)23-16-7-5-4-6-15(16)22/h4-12H,3H2,1-2H3,(H2,23,24,26)
InChIKey MLSCYUHWICRRFM-UHFFFAOYSA-N
Molecular Weight 430.906 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6204
Solvent DMSO-d6
Source Vendor ID: NMR/12718771