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2-PENTAFLUOROETHYL-INDOLE-3-ACETONITRILE
SpectraBase Compound ID 79GVfdqo2MD
InChI InChI=1S/C12H7F5N2/c13-11(14,12(15,16)17)10-8(5-6-18)7-3-1-2-4-9(7)19-10/h1-4,19H,5H2
InChIKey NCOSEARPEANSFO-UHFFFAOYSA-N
Mol Weight 274.19 g/mol
Molecular Formula C12H7F5N2
Exact Mass 274.052939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID i0Z3D5tKlT
Name 2-[2-(1,1,2,2,2-pentafluoroethyl)-1H-indol-3-yl]acetonitrile
Alternate Name(s) 2-[2-[1,1,2,2,2-pentakis(fluoranyl)ethyl]-1H-indol-3-yl]ethanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7F5N2
InChI InChI=1S/C12H7F5N2/c13-11(14,12(15,16)17)10-8(5-6-18)7-3-1-2-4-9(7)19-10/h1-4,19H,5H2
InChIKey NCOSEARPEANSFO-UHFFFAOYSA-N
Molecular Weight 274.194 g/mol
SMILES [nH]1c2ccccc2c(c1C(C(F)(F)F)(F)F)CC#N
SPLASH splash10-0ab9-0190000000-d5d48e4b688cd4e74fd9
Source of Spectrum E1-45-933-7
Wiley ID 1553979