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6-MORPHOLINO-2,5-DIPHENYL-2-TRIFLUOROMETHYL-2H-1,3,5-THIADIAZIN-5-IO-4-OLATE
SpectraBase Compound ID 9JrdZAkTH09
InChI InChI=1S/C20H18F3N3O2S/c21-20(22,23)19(15-7-3-1-4-8-15)24-17(27)26(16-9-5-2-6-10-16)18(29-19)25-11-13-28-14-12-25/h1-10H,11-14H2
InChIKey GKOPZWUZIOEYMZ-UHFFFAOYSA-N
Mol Weight 421.44 g/mol
Molecular Formula C20H18F3N3O2S
Exact Mass 421.107182 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BZG37lUhmBi
Name 6-MORPHOLINO-2,5-DIPHENYL-2-TRIFLUOROMETHYL-2H-1,3,5-THIADIAZIN-5-IO-4-OLATE
Comments SCALE INVERTED. IN (CD3)2CO MIXTURE OF CHAIN AND RING TAUTOMERS;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H18F3N3O2S
InChI InChI=1S/C20H18F3N3O2S/c21-20(22,23)19(15-7-3-1-4-8-15)24-17(27)26(16-9-5-2-6-10-16)18(29-19)25-11-13-28-14-12-25/h1-10H,11-14H2
InChIKey GKOPZWUZIOEYMZ-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, YU.N.DAVIDYUK, L.I.SAMARAI (1991) Ukrain.Khim.Zhurn.(Russ. Lang.):v.57, N12, 1316-1321.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6D6 benzene-d6