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2-METHYL-3-(ALPHA-CARBMETHOXY-ALPHA-TRIFLUOROACETAMIDOTRIFLUOROETHYL)INDOLE
SpectraBase Compound ID 1zuJrJoXUhj
InChI InChI=1S/C15H12F6N2O3/c1-7-10(8-5-3-4-6-9(8)22-7)13(12(25)26-2,15(19,20)21)23-11(24)14(16,17)18/h3-6,22H,1-2H3,(H,23,24)
InChIKey XRLCSDRCGCVJAB-UHFFFAOYSA-N
Mol Weight 382.26 g/mol
Molecular Formula C15H12F6N2O3
Exact Mass 382.075211 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9RBo6oJxxUV
Name 2-METHYL-3-(ALPHA-CARBMETHOXY-ALPHA-TRIFLUOROACETAMIDOTRIFLUOROETHYL)INDOLE
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 C15H12F6N2O3
InChI InChI=1S/C15H12F6N2O3/c1-7-10(8-5-3-4-6-9(8)22-7)13(12(25)26-2,15(19,20)21)23-11(24)14(16,17)18/h3-6,22H,1-2H3,(H,23,24)
InChIKey XRLCSDRCGCVJAB-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