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2-TRIFLUOROMETHYL-2,5-DIPHENYL-6-PHENYLIMINO-2H-3,4-DIHYDRO-1,3,5-THIADIAZIN-4-ONE
SpectraBase Compound ID I0CY8gM6TVB
InChI InChI=1S/C22H16F3N3OS/c23-22(24,25)21(16-10-4-1-5-11-16)27-19(29)28(18-14-8-3-9-15-18)20(30-21)26-17-12-6-2-7-13-17/h1-15H,(H,27,29)/b26-20-
InChIKey BKVSGKFSOGKEMG-QOMWVZHYSA-N
Mol Weight 427.45 g/mol
Molecular Formula C22H16F3N3OS
Exact Mass 427.096618 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ecGKlpgm1o
Name 2-TRIFLUOROMETHYL-2,5-DIPHENYL-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 C22H16F3N3OS
InChI InChI=1S/C22H16F3N3OS/c23-22(24,25)21(16-10-4-1-5-11-16)27-19(29)28(18-14-8-3-9-15-18)20(30-21)26-17-12-6-2-7-13-17/h1-15H,(H,27,29)/b26-20-
InChIKey BKVSGKFSOGKEMG-QOMWVZHYSA-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