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3-(2,2,2-Trifluoroethyl)-1H-indole-5-carbonitrile
SpectraBase Compound ID CFyOtVZX0yC
InChI InChI=1S/C11H7F3N2/c12-11(13,14)4-8-6-16-10-2-1-7(5-15)3-9(8)10/h1-3,6,16H,4H2
InChIKey VWDDOVXHNAKDKN-UHFFFAOYSA-N
Mol Weight 224.19 g/mol
Molecular Formula C11H7F3N2
Exact Mass 224.056133 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEYoW29UJzd
Name 3-(2,2,2-Trifluoroethyl)-1H-indole-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7F3N2
InChI InChI=1S/C11H7F3N2/c12-11(13,14)4-8-6-16-10-2-1-7(5-15)3-9(8)10/h1-3,6,16H,4H2
InChIKey VWDDOVXHNAKDKN-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c5cc00519a
Molecular Weight 224.186 g/mol
SMILES [nH]1cc(c2c1ccc(c2)C#N)CC(F)(F)F
SPLASH splash10-0a4i-0920000000-73c109fd9f9f40ce450f
Source of Spectrum KD-51-4488/SMS29-3u
Wiley ID 1760570