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2-(benzenesulfonamido)-3,3,3-trifluoro-2-(1H-indol-3-yl)propanoic acid methyl ester
SpectraBase Compound ID Bvf8FH3qAHe
InChI InChI=1S/C18H15F3N2O4S/c1-27-16(24)17(18(19,20)21,14-11-22-15-10-6-5-9-13(14)15)23-28(25,26)12-7-3-2-4-8-12/h2-11,22-23H,1H3
InChIKey FVZXGNIMLMYIQO-UHFFFAOYSA-N
Mol Weight 412.38 g/mol
Molecular Formula C18H15F3N2O4S
Exact Mass 412.070463 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3JxeM1vKHhQ
Name 3-(ALPHA-CARBMETHOXY-ALPHA-BENZENSULPHAMIDOTRIFLUOROETHYL)INDOL
Comments SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H15F3N2O4S
InChI InChI=1S/C18H15F3N2O4S/c1-27-16(24)17(18(19,20)21,14-11-22-15-10-6-5-9-13(14)15)23-28(25,26)12-7-3-2-4-8-12/h2-11,22-23H,1H3
InChIKey FVZXGNIMLMYIQO-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference S.N.OSIPOV, N.D.CHKANIKOV, A.F.KOLOMIETS, A.V.FOKIN (1986) Izv.Akad.NaukSSSR(Russ. Lang.): N6, 1384-1387.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3H6O acetone