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(E)-6-(4-(Trifluoromethyl)phenyl)hex-3-en-5-yn-2-one

View entire compound with spectra: 1 MS (GC)

(E)-6-(4-(Trifluoromethyl)phenyl)hex-3-en-5-yn-2-one
SpectraBase Compound ID 5vd3P8gLcXK
InChI InChI=1S/C13H9F3O/c1-10(17)4-2-3-5-11-6-8-12(9-7-11)13(14,15)16/h2,4,6-9H,1H3/b4-2+
InChIKey CZGGXAADZOMWSM-DUXPYHPUSA-N
Mol Weight 238.21 g/mol
Molecular Formula C13H9F3O
Exact Mass 238.060549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58NMPSaVbE
Name (E)-6-(4-(Trifluoromethyl)phenyl)hex-3-en-5-yn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9F3O
InChI InChI=1S/C13H9F3O/c1-10(17)4-2-3-5-11-6-8-12(9-7-11)13(14,15)16/h2,4,6-9H,1H3/b4-2+
InChIKey CZGGXAADZOMWSM-DUXPYHPUSA-N
Literature Reference DOI 10.1021/ol502551u
Molecular Weight 238.209 g/mol
SMILES c1(ccc(C#C\C=C\C(C)=O)cc1)C(F)(F)F
SPLASH splash10-0079-0390000000-d81d00c9949a812545fd
Source of Spectrum A1-16-5188/SM6-2d
Wiley ID 1751355