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3-thiophenecarboxylic acid, 4-methyl-5-phenyl-2-[[2,2,2-trifluoro-1-(methoxycarbonyl)-1-[(4-methylbenzoyl)amino]ethyl]amino]-, ethyl ester

View entire compound with spectra: 1 NMR

3-thiophenecarboxylic acid, 4-methyl-5-phenyl-2-[[2,2,2-trifluoro-1-(methoxycarbonyl)-1-[(4-methylbenzoyl)amino]ethyl]amino]-, ethyl ester
SpectraBase Compound ID DYX3erRmsDS
InChI InChI=1S/C26H25F3N2O5S/c1-5-36-23(33)19-16(3)20(17-9-7-6-8-10-17)37-22(19)31-25(24(34)35-4,26(27,28)29)30-21(32)18-13-11-15(2)12-14-18/h6-14,31H,5H2,1-4H3,(H,30,32)
InChIKey PCQTYUFENCRGMD-UHFFFAOYSA-N
Mol Weight 534.55 g/mol
Molecular Formula C26H25F3N2O5S
Exact Mass 534.143628 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B8eQAQNmu3T
Name 3-thiophenecarboxylic acid, 4-methyl-5-phenyl-2-[[2,2,2-trifluoro-1-(methoxycarbonyl)-1-[(4-methylbenzoyl)amino]ethyl]amino]-, 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 534.143627571 u
Formula C26H25F3N2O5S
InChI InChI=1S/C26H25F3N2O5S/c1-5-36-23(33)19-16(3)20(17-9-7-6-8-10-17)37-22(19)31-25(24(34)35-4,26(27,28)29)30-21(32)18-13-11-15(2)12-14-18/h6-14,31H,5H2,1-4H3,(H,30,32)
InChIKey PCQTYUFENCRGMD-UHFFFAOYSA-N
Molecular Weight 534.550 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12214
Solvent DMSO-d6
Source Vendor ID: NMR/10260727; Lab Info: AU; Lab Number: AU-0000054