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2-(4'-TRIFLUOROMETHYLPHENYL)-INDOLE-1-CARBOXYLIC-ACID-TERT.-BUTYLESTER
SpectraBase Compound ID B9Nc1tBvr6m
InChI InChI=1S/C20H18F3NO2/c1-19(2,3)26-18(25)24-16-7-5-4-6-14(16)12-17(24)13-8-10-15(11-9-13)20(21,22)23/h4-12H,1-3H3
InChIKey JRLCKSURJYTSFO-UHFFFAOYSA-N
Mol Weight 361.36 g/mol
Molecular Formula C20H18F3NO2
Exact Mass 361.128963 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LMgIZlLxbAf
Name 2-(4'-TRIFLUOROMETHYLPHENYL)-INDOLE-1-CARBOXYLIC-ACID-TERT.-BUTYLESTER
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18F3NO2
InChI InChI=1S/C20H18F3NO2/c1-19(2,3)26-18(25)24-16-7-5-4-6-14(16)12-17(24)13-8-10-15(11-9-13)20(21,22)23/h4-12H,1-3H3
InChIKey JRLCKSURJYTSFO-UHFFFAOYSA-N
Literature Reference Author S.E.DENMARK,J.D.BAIRD
Literature Reference Citation ORG.LETTERS,6,3649(2004)
Literature Reference DOI 10.1021/ol048328a
Solvent CDCl3
Source File Reference UWLU50914