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N-(2-((4-cyanophenyl)ethynyl)phenyl)-2,2,2-trifluoroacetimidoyl chloride
SpectraBase Compound ID 4ynbl3COaRt
InChI InChI=1S/C17H8ClF3N2/c18-16(17(19,20)21)23-15-4-2-1-3-14(15)10-9-12-5-7-13(11-22)8-6-12/h1-8H
InChIKey IKPFNVOUBACEBH-UHFFFAOYSA-N
Mol Weight 332.71 g/mol
Molecular Formula C17H8ClF3N2
Exact Mass 332.03281 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 527bwqK2e7o
Name N-(2-((4-cyanophenyl)ethynyl)phenyl)-2,2,2-trifluoroacetimidoyl chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H8ClF3N2
InChI InChI=1S/C17H8ClF3N2/c18-16(17(19,20)21)23-15-4-2-1-3-14(15)10-9-12-5-7-13(11-22)8-6-12/h1-8H
InChIKey IKPFNVOUBACEBH-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5RA05967D
Molecular Weight 332.713 g/mol
SMILES c1(N=C(C(F)(F)F)Cl)ccccc1C#Cc1ccc(cc1)C#N
SPLASH splash10-0059-0394000000-a5eb462574b9c0f71887
Source of Spectrum RSA-5-39625/SM5-1g
Wiley ID 1805515