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2-Cyano-3-(1-pyrrolidinyl)-N-[2,2,2-trifluoro-1-(4-methylphenyl)ethylidene]-2-butenamide
SpectraBase Compound ID K7Z4TyIrcH5
InChI InChI=1S/C18H18F3N3O/c1-12-5-7-14(8-6-12)16(18(19,20)21)23-17(25)15(11-22)13(2)24-9-3-4-10-24/h5-8H,3-4,9-10H2,1-2H3/b15-13+,23-16+
InChIKey FZJUFZJIIARCRP-LQKQQMOUSA-N
Mol Weight 349.36 g/mol
Molecular Formula C18H18F3N3O
Exact Mass 349.140197 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrCUfdYqJJV
Name 2-Cyano-3-(1-pyrrolidinyl)-N-[2,2,2-trifluoro-1-(4-methylphenyl)ethylidene]-2-butenamide
Alternate Name(s) (2E)-2-cyano-3-(1-pyrrolidinyl)-N-[(E)-2,2,2-trifluoro-1-(4-methylphenyl)ethylidene]-2-butenamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18F3N3O
InChI InChI=1S/C18H18F3N3O/c1-12-5-7-14(8-6-12)16(18(19,20)21)23-17(25)15(11-22)13(2)24-9-3-4-10-24/h5-8H,3-4,9-10H2,1-2H3/b15-13+,23-16+
InChIKey FZJUFZJIIARCRP-LQKQQMOUSA-N
Molecular Weight 349.357 g/mol
SMILES C(\C(=C/(N1CCCC1)C)C#N)(\N=C\(C(F)(F)F)c1ccc(cc1)C)=O
SPLASH splash10-03di-0901000000-33c97bca5e4c0733096c
Source of Spectrum C5-2004-2202-6
Wiley ID 1617279