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5,7-BIS(2-HYDROXYHEXAFLUOROPROP-2-YL)-3-METHOXYCARBONYLMETHYLINDOLE
SpectraBase Compound ID B6WBTSiaFV7
InChI InChI=1S/C17H11F12NO4/c1-34-10(31)2-6-5-30-11-8(6)3-7(12(32,14(18,19)20)15(21,22)23)4-9(11)13(33,16(24,25)26)17(27,28)29/h3-5,30,32-33H,2H2,1H3
InChIKey YXZTVRODIIHAHV-UHFFFAOYSA-N
Mol Weight 521.26 g/mol
Molecular Formula C17H11F12NO4
Exact Mass 521.049646 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5QNMdZYgot
Name 5,7-BIS(2-HYDROXYHEXAFLUOROPROP-2-YL)-3-METHOXYCARBONYLMETHYLINDOLE
Comments SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H11F12NO4
InChI InChI=1S/C17H11F12NO4/c1-34-10(31)2-6-5-30-11-8(6)3-7(12(32,14(18,19)20)15(21,22)23)4-9(11)13(33,16(24,25)26)17(27,28)29/h3-5,30,32-33H,2H2,1H3
InChIKey YXZTVRODIIHAHV-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.E.ZELENIN, N.D.CHKANNIKOV, A.F.KOLOMIETS, A.V.FOKIN (1988) Izv.Akad.NaukSSSR(Russ. Lang.): N1, 121-127.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6