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1-(Trifluoromethyl)-4-((1E,4Z)-7-methylenetrideca-1,4-dienyl)-benzene
SpectraBase Compound ID 1Wt5V619nh4
InChI InChI=1S/C21H27F3/c1-3-4-5-8-11-18(2)12-9-6-7-10-13-19-14-16-20(17-15-19)21(22,23)24/h6,9-10,13-17H,2-5,7-8,11-12H2,1H3/b9-6-,13-10+
InChIKey YUHAKFSDNDTHDJ-OWQKPFLESA-N
Mol Weight 336.44 g/mol
Molecular Formula C21H27F3
Exact Mass 336.206485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3g9IXffIYaN
Name 1-(Trifluoromethyl)-4-((1E,4Z)-7-methylenetrideca-1,4-dienyl)-benzene
Alternate Name(s) 1-((1E,4Z)-7-methylenetrideca-1,4-dien-1-yl)-4-(trifluoromethyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27F3
InChI InChI=1S/C21H27F3/c1-3-4-5-8-11-18(2)12-9-6-7-10-13-19-14-16-20(17-15-19)21(22,23)24/h6,9-10,13-17H,2-5,7-8,11-12H2,1H3/b9-6-,13-10+
InChIKey YUHAKFSDNDTHDJ-OWQKPFLESA-N
Literature Reference DOI 10.1021/ol401015e
Molecular Weight 336.442 g/mol
SMILES c1(ccc(cc1)C(F)(F)F)\C=C\C\C=C/CC(=C)CCCCCC
SPLASH splash10-0a4i-0961000000-24fa0fc7ec7d3a230585
Source of Spectrum A1-15-2708/SM14-8b
Wiley ID 1748699