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methyl 2-{[1-(benzoylamino)-1-(ethoxycarbonyl)-2,2,2-trifluoroethyl]amino}-4-ethyl-5-methyl-3-thiophenecarboxylate
SpectraBase Compound ID 8s6YS6yrd0S
InChI InChI=1S/C21H23F3N2O5S/c1-5-14-12(3)32-17(15(14)18(28)30-4)26-20(21(22,23)24,19(29)31-6-2)25-16(27)13-10-8-7-9-11-13/h7-11,26H,5-6H2,1-4H3,(H,25,27)
InChIKey IGJPSYGWUHOGAO-UHFFFAOYSA-N
Mol Weight 472.48 g/mol
Molecular Formula C21H23F3N2O5S
Exact Mass 472.127978 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4nIUdo28X8Z
Name methyl 2-{[1-(benzoylamino)-1-(ethoxycarbonyl)-2,2,2-trifluoroethyl]amino}-4-ethyl-5-methyl-3-thiophenecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H23F3N2O5S/c1-5-14-12(3)32-17(15(14)18(28)30-4)26-20(21(22,23)24,19(29)31-6-2)25-16(27)13-10-8-7-9-11-13/h7-11,26H,5-6H2,1-4H3,(H,25,27)
InChIKey IGJPSYGWUHOGAO-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3265
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/10211666; Labnumber: AU-EC00989