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1-METHYL-2-PHENYL-3-(ALPHA-HYDROXYHEXAFLUOROISOPROPYL)INDOLE
SpectraBase Compound ID GDjwOiS1fxI
InChI InChI=1S/C18H13F6NO/c1-25-13-10-6-5-9-12(13)14(15(25)11-7-3-2-4-8-11)16(26,17(19,20)21)18(22,23)24/h2-10,26H,1H3
InChIKey BYVSUPNRGBTEJM-UHFFFAOYSA-N
Mol Weight 373.3 g/mol
Molecular Formula C18H13F6NO
Exact Mass 373.090133 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lr82OwUcOHg
Name 1-METHYL-2-PHENYL-3-(ALPHA-HYDROXYHEXAFLUOROISOPROPYL)INDOLE
Comments SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H13F6NO
InChI InChI=1S/C18H13F6NO/c1-25-13-10-6-5-9-12(13)14(15(25)11-7-3-2-4-8-11)16(26,17(19,20)21)18(22,23)24/h2-10,26H,1H3
InChIKey BYVSUPNRGBTEJM-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.E.ZELENIN, N.D.CHKANIKOV, YU.N.IVANCHENKO, V.D.TKACHEV, V.A.RUSAKOVA,A.F.KOLOMIETS, A.V.FOKIN (1987) Khim.Heteroc.Soed.(Russ. Lang.): N9, 1200-1201.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3H6O acetone