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2-TRIFLUOROMETHYL-2-(PARA-TOLYL)-5-PHENYL-6-PHENYLIMINO-2H-3,4-DIHYDRO-1,3,5-THIADIAZIN-4-ONE
SpectraBase Compound ID LdXoQtess7x
InChI InChI=1S/C23H18F3N3OS/c1-16-12-14-17(15-13-16)22(23(24,25)26)28-20(30)29(19-10-6-3-7-11-19)21(31-22)27-18-8-4-2-5-9-18/h2-15H,1H3,(H,28,30)/b27-21-
InChIKey XZHGCWUCZQEFOW-MEFGMAGPSA-N
Mol Weight 441.47 g/mol
Molecular Formula C23H18F3N3OS
Exact Mass 441.112268 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GyRHt7h1Gsb
Name 2-TRIFLUOROMETHYL-2-(PARA-TOLYL)-5-PHENYL-6-PHENYLIMINO-2H-3,4-DIHYDRO-1,3,5-THIADIAZIN-4-ONE
Comments SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H18F3N3OS
InChI InChI=1S/C23H18F3N3OS/c1-16-12-14-17(15-13-16)22(23(24,25)26)28-20(30)29(19-10-6-3-7-11-19)21(31-22)27-18-8-4-2-5-9-18/h2-15H,1H3,(H,28,30)/b27-21-
InChIKey XZHGCWUCZQEFOW-MEFGMAGPSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, YU.N.DAVIDYUK, L.I.SAMARAI (1992) Ukrain.Khim.Zhurn.(Russ. Lang.):v.58, N1, 54-57.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d