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Ethyl 3-(trifluoromethyl)-7-phenylhepta-2,4-dien-6-ynoate
SpectraBase Compound ID IUf3mKBC7r
InChI InChI=1S/C16H13F3O2/c1-2-21-15(20)12-14(16(17,18)19)11-7-6-10-13-8-4-3-5-9-13/h3-5,7-9,11-12H,2H2,1H3/b11-7+,14-12-
InChIKey VMTQUWRTUXSASN-HYIMWACQSA-N
Mol Weight 294.27 g/mol
Molecular Formula C16H13F3O2
Exact Mass 294.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVri5T6xDy5
Name Ethyl 3-(trifluoromethyl)-7-phenylhepta-2,4-dien-6-ynoate
Alternate Name(s) Ethyl (2Z,4E)-7-phenyl-3-(trifluoromethyl)-2,4-heptadien-6-ynoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13F3O2
InChI InChI=1S/C16H13F3O2/c1-2-21-15(20)12-14(16(17,18)19)11-7-6-10-13-8-4-3-5-9-13/h3-5,7-9,11-12H,2H2,1H3/b11-7+,14-12-
InChIKey VMTQUWRTUXSASN-HYIMWACQSA-N
Molecular Weight 294.273 g/mol
SMILES C(\C(=C/C(=O)OCC)\C=C\C#Cc1ccccc1)(F)(F)F
SPLASH splash10-0a4i-1920000000-aca12991e1de5fd17e86
Source of Spectrum Y2-27-439-9
Wiley ID 1547390