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2-CYANO-4-(TRIFLUOROMETHYLTHIO)-3,5,6-TRICHLOROPYRIDINE
SpectraBase Compound ID Czehl39MCWJ
InChI InChI=1S/C7Cl3F3N2S/c8-3-2(1-14)15-6(10)4(9)5(3)16-7(11,12)13
InChIKey LYSHKZCSTLWXNR-UHFFFAOYSA-N
Mol Weight 307.51 g/mol
Molecular Formula C7Cl3F3N2S
Exact Mass 305.879987 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QW5gRd8qBt
Name 4-TRIFLUOROMETHYLTHIO-3,5,6-TRICHLORO-2-CYANOPYRIDINE
Comments INTERNAL STANDARD - CF3COOH (-77.0 FROM CFCL3).;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7Cl3F3N2S
InChI InChI=1S/C7Cl3F3N2S/c8-3-2(1-14)15-6(10)4(9)5(3)16-7(11,12)13
InChIKey LYSHKZCSTLWXNR-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.M.SIPYAGIN, I.A.POMYTKIN, S.V.PAL'TSUN, N.N.ALEINIKOV, V.G.KARTSEV (1990)Dokl.Akad.Nauk SSSR(Russ. Lang.): v.311, N5, 1137-1139.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d