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2-(ALPHA-CARBMETHOXY-ALPHA-TRIFLUOROACETAMIDOTRIFLUOROETHYL)-3-METHYL-4,5-DIPHENYLTHIOPHENE
SpectraBase Compound ID 2yijnSymP98
InChI InChI=1S/C23H17F6NO3S/c1-13-16(14-9-5-3-6-10-14)17(15-11-7-4-8-12-15)34-18(13)21(20(32)33-2,23(27,28)29)30-19(31)22(24,25)26/h3-12H,1-2H3,(H,30,31)
InChIKey QUQZUMLJYQYEGL-UHFFFAOYSA-N
Mol Weight 501.44 g/mol
Molecular Formula C23H17F6NO3S
Exact Mass 501.083334 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4gZiD0n3Aju
Name 2-(ALPHA-CARBMETHOXY-ALPHA-TRIFLUOROACETAMIDOTRIFLUOROETHYL)-3-METHYL-4,5-DIPHENYLTHIOPHENE
Comments ALL PEAKS WERE ASSIGNED (S.T.). SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H17F6NO3S
InChI InChI=1S/C23H17F6NO3S/c1-13-16(14-9-5-3-6-10-14)17(15-11-7-4-8-12-15)34-18(13)21(20(32)33-2,23(27,28)29)30-19(31)22(24,25)26/h3-12H,1-2H3,(H,30,31)
InChIKey QUQZUMLJYQYEGL-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference S.N.OSIPOV, N.D.CHKANIKOV, YU.V.SHKLYAEV, A.F.KOLOMIETS, A.V.FOKIN (1989)Izv.Akad.Nauk SSSR(Russ. Lang.): N9, 2131-2134.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported