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3-Thiophenecarboxylic acid, 4-ethyl-5-methyl-2-[[2,2,2-trifluoro-1-[(2-phenylacetyl)amino]-1-(trifluoromethyl)ethyl]amino]-, methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-Thiophenecarboxylic acid, 4-ethyl-5-methyl-2-[[2,2,2-trifluoro-1-[(2-phenylacetyl)amino]-1-(trifluoromethyl)ethyl]amino]-, methyl ester
SpectraBase Compound ID DbY6R10Gc6
InChI InChI=1S/C20H20F6N2O3S/c1-4-13-11(2)32-16(15(13)17(30)31-3)28-18(19(21,22)23,20(24,25)26)27-14(29)10-12-8-6-5-7-9-12/h5-9,28H,4,10H2,1-3H3,(H,27,29)
InChIKey URALGNZDKKWLSA-UHFFFAOYSA-N
Mol Weight 482.44 g/mol
Molecular Formula C20H20F6N2O3S
Exact Mass 482.109883 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IPasXSVwxhX
Name methyl 4-ethyl-5-methyl-2-{[2,2,2-trifluoro-1-[(phenylacetyl)amino]-1-(trifluoromethyl)ethyl]amino}-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/C20H20F6N2O3S/c1-4-13-11(2)32-16(15(13)17(30)31-3)28-18(19(21,22)23,20(24,25)26)27-14(29)10-12-8-6-5-7-9-12/h5-9,28H,4,10H2,1-3H3,(H,27,29)
InChIKey URALGNZDKKWLSA-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_464
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: C27178; Labnumber: SOK-1107; SBI_ID: SBI-000466
Temperature 308 °C