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3-Phenyl-1-(4-(trifluoromethyl)phenyl)prop-2-yn-1-one
SpectraBase Compound ID I1F1wP9cY6D
InChI InChI=1S/C16H9F3O/c17-16(18,19)14-9-7-13(8-10-14)15(20)11-6-12-4-2-1-3-5-12/h1-5,7-10H
InChIKey MWGLXUHTYIHCES-UHFFFAOYSA-N
Mol Weight 274.24 g/mol
Molecular Formula C16H9F3O
Exact Mass 274.060549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oPdFTZX0o8
Name 3-Phenyl-1-(4-(trifluoromethyl)phenyl)prop-2-yn-1-one
Alternate Name(s) 3-Phenyl-1-[4-(trifluoromethyl)phenyl]-2-propyn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9F3O
InChI InChI=1S/C16H9F3O/c17-16(18,19)14-9-7-13(8-10-14)15(20)11-6-12-4-2-1-3-5-12/h1-5,7-10H
InChIKey MWGLXUHTYIHCES-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol102993y
Molecular Weight 274.242 g/mol
SMILES C(#Cc1ccccc1)C(=O)c1ccc(cc1)C(F)(F)F
SPLASH splash10-0092-0390000000-88734f5e131271ac8e93
Source of Spectrum A1-13-944/SMS5-3ia
Wiley ID 1752754