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3-BENZYL-3-(TRIFLUOROMETHYL)-HEX-5-EN-2-ONE
SpectraBase Compound ID AGOxNJ1GSZm
InChI InChI=1S/C14H15F3O/c1-3-9-13(11(2)18,14(15,16)17)10-12-7-5-4-6-8-12/h3-8H,1,9-10H2,2H3
InChIKey YFYFSNXXDXQJAC-UHFFFAOYSA-N
Mol Weight 256.27 g/mol
Molecular Formula C14H15F3O
Exact Mass 256.1075 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EVMUelJiGrC
Name 3-BENZYL-3-(TRIFLUOROMETHYL)-HEX-5-EN-2-ONE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H15F3O
InChI InChI=1S/C14H15F3O/c1-3-9-13(11(2)18,14(15,16)17)10-12-7-5-4-6-8-12/h3-8H,1,9-10H2,2H3
InChIKey YFYFSNXXDXQJAC-UHFFFAOYSA-N
Literature Reference Author K.SATO,Y.ATKIGUCHI,Y.YOSHIZAWA,K.IWASE,Y.SHIMIZU,A.TARUI,M.O MOTE,I.KUMADAKI,A.AN
Literature Reference Citation CHEM.PHARM.BULL.,55,1593(2007)
Literature Reference DOI 10.1248/cpb.55.1593
Solvent CDCl3
Source File Reference UWLU56628