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butanamide, 2-[[3-cyano-5-(2-thienylcarbonyl)-6-(trifluoromethyl)-2-pyridinyl]thio]-N,N-dimethyl-3-oxo-
SpectraBase Compound ID HWcHXtJpSdB
InChI InChI=1S/C18H14F3N3O3S2/c1-9(25)14(17(27)24(2)3)29-16-10(8-22)7-11(15(23-16)18(19,20)21)13(26)12-5-4-6-28-12/h4-7,14H,1-3H3
InChIKey RKKXXHFCQOEPPJ-UHFFFAOYSA-N
Mol Weight 441.44 g/mol
Molecular Formula C18H14F3N3O3S2
Exact Mass 441.042868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DpW6mVCYPst
Name butanamide, 2-[[3-cyano-5-(2-thienylcarbonyl)-6-(trifluoromethyl)-2-pyridinyl]thio]-N,N-dimethyl-3-oxo-
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/C18H14F3N3O3S2/c1-9(25)14(17(27)24(2)3)29-16-10(8-22)7-11(15(23-16)18(19,20)21)13(26)12-5-4-6-28-12/h4-7,14H,1-3H3
InChIKey RKKXXHFCQOEPPJ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2220
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: F14560; Labnumber: SHEL-S0837-0035