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(E)-3-(5-Methyl-4-oxo-hexylidene)-1-(4-trifluoromethyl-phenyl)-piperidin-2-one
SpectraBase Compound ID F0CQpG5rfXn
InChI InChI=1S/C19H22F3NO2/c1-13(2)17(24)7-3-5-14-6-4-12-23(18(14)25)16-10-8-15(9-11-16)19(20,21)22/h5,8-11,13H,3-4,6-7,12H2,1-2H3/b14-5+
InChIKey RPVFFJFCALTEPQ-LHHJGKSTSA-N
Mol Weight 353.39 g/mol
Molecular Formula C19H22F3NO2
Exact Mass 353.160263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwO5rnU1y3g
Name (E)-3-(5-Methyl-4-oxo-hexylidene)-1-(4-trifluoromethyl-phenyl)-piperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22F3NO2
InChI InChI=1S/C19H22F3NO2/c1-13(2)17(24)7-3-5-14-6-4-12-23(18(14)25)16-10-8-15(9-11-16)19(20,21)22/h5,8-11,13H,3-4,6-7,12H2,1-2H3/b14-5+
InChIKey RPVFFJFCALTEPQ-LHHJGKSTSA-N
Literature Reference DOI 10.1021/ol8017209
Molecular Weight 353.385 g/mol
SMILES c1cc(C(F)(F)F)ccc1N1CCC\C(=C/CCC(C(C)C)=O)C1=O
SPLASH splash10-0002-9330000000-245411c1107354bfab36
Source of Spectrum A1-10-4291/SMS21-E_4k
Synonyms (E)-3-(5-methyl-4-oxohexylidene)-1-(4-(trifluoromethyl)phenyl)piperidin-2-one (3E)-3-(5-methyl-4-oxohexylidene)-1-[4-(trifluoromethyl)phenyl]-2-piperidinone (3E)-3-(5-methyl-4-oxohexylidene)-1-[4-(trifluoromethyl)phenyl]piperidin-2-one (3E)-3-(5-methyl-4-oxo-hexylidene)-1-[4-(trifluoromethyl)phenyl]piperidin-2-one (3E)-3-(5-methyl-4-oxidanylidene-hexylidene)-1-[4-(trifluoromethyl)phenyl]piperidin-2-one
Wiley ID 1759894