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2,3,3-TRIMETHYL-5-TRIFLUOROMETHYLINDOLENINE, IODOMETHYLATE
SpectraBase Compound ID BLNGMAbef5x
InChI InChI=1S/C13H15F3N.HI/c1-8-12(2,3)10-7-9(13(14,15)16)5-6-11(10)17(8)4;/h5-7H,1-4H3;1H/q+1;/p-1
InChIKey RMXVMGQUAGFLBX-UHFFFAOYSA-M
Mol Weight 369.17 g/mol
Molecular Formula C13H15F3IN
Exact Mass 369.020129 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3wwslNMCQTp
Name 2,3,3-TRIMETHYL-5-TRIFLUOROMETHYLINDOLENINE, IODOMETHYLATE
Comments '+' DIRECTION-LOW FIELD, SOLVEBT 70% CH3CN, 30% H2O
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H15F3IN
InChI InChI=1S/C13H15F3N.HI/c1-8-12(2,3)10-7-9(13(14,15)16)5-6-11(10)17(8)4;/h5-7H,1-4H3;1H/q+1;/p-1
InChIKey RMXVMGQUAGFLBX-UHFFFAOYSA-M
Instrument Name Tesla BS487
Literature Reference V.I.TROITSKAYA, I.G.OKSENGENDLER, S.V.PAZENOK, M.S.LYUBICH, S.M.LARINA,L.M.YAGUPOL'SKY (1982) Khim.Heteroc.Soed.(Russ. Lang.): N1, 47-51.
NMR Standard C6H5CF3
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2H3N acetonitrile