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3-pyridinecarboxamide, N-[1-[(3-cyano-4-ethyl-5-methyl-2-thienyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-
SpectraBase Compound ID 7yJyCzN4Ash
InChI InChI=1S/C17H14F6N4OS/c1-3-11-9(2)29-14(12(11)7-24)27-15(16(18,19)20,17(21,22)23)26-13(28)10-5-4-6-25-8-10/h4-6,8,27H,3H2,1-2H3,(H,26,28)
InChIKey APZLJWNQTINMNG-UHFFFAOYSA-N
Mol Weight 436.38 g/mol
Molecular Formula C17H14F6N4OS
Exact Mass 436.079251 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kailb3v0B5n
Name 3-pyridinecarboxamide, N-[1-[(3-cyano-4-ethyl-5-methyl-2-thienyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.079251238 u
Formula C17H14F6N4OS
InChI InChI=1S/C17H14F6N4OS/c1-3-11-9(2)29-14(12(11)7-24)27-15(16(18,19)20,17(21,22)23)26-13(28)10-5-4-6-25-8-10/h4-6,8,27H,3H2,1-2H3,(H,26,28)
InChIKey APZLJWNQTINMNG-UHFFFAOYSA-N
Molecular Weight 436.376 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9981
Solvent ACETONE-d6
Source Vendor ID: NMR/9290729; Lab Info: AU; Lab Number: AU-0000461