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

View entire compound with spectra: 1 NMR

3-thiophenecarboxylic acid, 2-[[1-(benzoylamino)-2,2,2-trifluoro-1-(methoxycarbonyl)ethyl]amino]-5-ethyl-4-phenyl-, ethyl ester
SpectraBase Compound ID yP18oMaM28
InChI InChI=1S/C26H25F3N2O5S/c1-4-18-19(16-12-8-6-9-13-16)20(23(33)36-5-2)22(37-18)31-25(24(34)35-3,26(27,28)29)30-21(32)17-14-10-7-11-15-17/h6-15,31H,4-5H2,1-3H3,(H,30,32)
InChIKey LGTDDKSHNZPKTR-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 Jh9iGgkCKgE
Name 3-thiophenecarboxylic acid, 2-[[1-(benzoylamino)-2,2,2-trifluoro-1-(methoxycarbonyl)ethyl]amino]-5-ethyl-4-phenyl-, 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/c1-4-18-19(16-12-8-6-9-13-16)20(23(33)36-5-2)22(37-18)31-25(24(34)35-3,26(27,28)29)30-21(32)17-14-10-7-11-15-17/h6-15,31H,4-5H2,1-3H3,(H,30,32)
InChIKey LGTDDKSHNZPKTR-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_12220
Solvent DMSO-d6
Source Vendor ID: NMR/10260736; Lab Info: AU; Lab Number: AU-0000063