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4-(2-(trifluoromethyl)-1H-indole-3-carbonyl)benzonitrile
SpectraBase Compound ID FZdwi44K0Ut
InChI InChI=1S/C17H9F3N2O/c18-17(19,20)16-14(12-3-1-2-4-13(12)22-16)15(23)11-7-5-10(9-21)6-8-11/h1-8,22H
InChIKey ATVBBBHYKALNHU-UHFFFAOYSA-N
Mol Weight 314.27 g/mol
Molecular Formula C17H9F3N2O
Exact Mass 314.066697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ACmeLdx0bSD
Name 4-(2-(trifluoromethyl)-1H-indole-3-carbonyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H9F3N2O
InChI InChI=1S/C17H9F3N2O/c18-17(19,20)16-14(12-3-1-2-4-13(12)22-16)15(23)11-7-5-10(9-21)6-8-11/h1-8,22H
InChIKey ATVBBBHYKALNHU-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5RA05967D
Molecular Weight 314.267 g/mol
SMILES [nH]1c2ccccc2c(c1C(F)(F)F)C(=O)c1ccc(cc1)C#N
SPLASH splash10-0ik9-0953000000-3aa086b19bd99cf7cf24
Source of Spectrum RSA-5-39625/SM10-2g
Wiley ID 1805530