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E/Z 3-(5-Methyl-4-oxo-hexylidene)-1-(4-trifluoromethyl-phenyl)-pyrrolidin-2-one
SpectraBase Compound ID 5L7VEn6Ux4Z
InChI InChI=1S/C18H20F3NO2/c1-12(2)16(23)5-3-4-13-10-11-22(17(13)24)15-8-6-14(7-9-15)18(19,20)21/h4,6-9,12H,3,5,10-11H2,1-2H3/b13-4+
InChIKey DGGQEBGKAOOHKV-YIXHJXPBSA-N
Mol Weight 339.36 g/mol
Molecular Formula C18H20F3NO2
Exact Mass 339.144613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9odN1dfog4y
Name E/Z 3-(5-Methyl-4-oxo-hexylidene)-1-(4-trifluoromethyl-phenyl)-pyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20F3NO2
InChI InChI=1S/C18H20F3NO2/c1-12(2)16(23)5-3-4-13-10-11-22(17(13)24)15-8-6-14(7-9-15)18(19,20)21/h4,6-9,12H,3,5,10-11H2,1-2H3/b13-4+
InChIKey DGGQEBGKAOOHKV-YIXHJXPBSA-N
Literature Reference DOI 10.1021/ol8017209
Molecular Weight 339.358 g/mol
SMILES C1\C(=C/CCC(C(C)C)=O)C(=O)N(c2ccc(C(F)(F)F)cc2)C1
SPLASH splash10-00sj-9610000000-6088c994d1ef775338c4
Source of Spectrum A1-10-4291/SMS18-4e
Synonyms (E)-3-(5-methyl-4-oxohexylidene)-1-(4-(trifluoromethyl)phenyl)pyrrolidin-2-one
Wiley ID 1759867