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2-Phenylethynyl-5-trifluoromethylaniline
SpectraBase Compound ID ICvUF2W18FW
InChI InChI=1S/C15H10F3N/c16-15(17,18)13-9-8-12(14(19)10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10H,19H2
InChIKey PZYSXUXVIWLIIB-UHFFFAOYSA-N
Mol Weight 261.25 g/mol
Molecular Formula C15H10F3N
Exact Mass 261.076534 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4WhYnL8Ql11
Name 2-Phenylethynyl-5-trifluoromethylaniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10F3N
InChI InChI=1S/C15H10F3N/c16-15(17,18)13-9-8-12(14(19)10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10H,19H2
InChIKey PZYSXUXVIWLIIB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000642
Molecular Weight 261.247 g/mol
SMILES Nc1c(ccc(c1)C(F)(F)F)C#Cc1ccccc1
SPLASH splash10-03di-0390000000-47035baa2d15cb7e1019
Source of Spectrum ASC-352-3355/SM7-1j
Synonyms 2-(Phenylethynyl)-5-(trifluoromethyl)aniline
Wiley ID 1764186