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2-([3-Cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]sulfanyl)-N,N-diethylacetamide
SpectraBase Compound ID 4NiK9oeZbac
InChI InChI=1S/C17H16F3N3OS2/c1-3-23(4-2)15(24)10-26-16-11(9-21)12(17(18,19)20)8-13(22-16)14-6-5-7-25-14/h5-8H,3-4,10H2,1-2H3
InChIKey NZKOOBXCIIKYDJ-UHFFFAOYSA-N
Mol Weight 399.45 g/mol
Molecular Formula C17H16F3N3OS2
Exact Mass 399.068689 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HWtX0B0E7gN
Name acetamide, 2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]thio]-N,N-diethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.068688983 u
Formula C17H16F3N3OS2
InChI InChI=1S/C17H16F3N3OS2/c1-3-23(4-2)15(24)10-26-16-11(9-21)12(17(18,19)20)8-13(22-16)14-6-5-7-25-14/h5-8H,3-4,10H2,1-2H3
InChIKey NZKOOBXCIIKYDJ-UHFFFAOYSA-N
Molecular Weight 399.450 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4694
Solvent DMSO-d6
Source Vendor ID: ZI/9066043; Lab Info: NKS; Lab Number: NKS-8200027