copper; (Z)-1,1,1-trifluoro-4-[2-[[(Z)-5,5,5-trifluoro-4-oxopent-2-en-2-yl]amino]anilino]pent-3-en-2-one

SpectraBase Compound ID	ML9ypNndnX
InChI	InChI=1S/C16H14F6N2O2.Cu/c1-9(7-13(25)15(17,18)19)23-11-5-3-4-6-12(11)24-10(2)8-14(26)16(20,21)22;/h3-8,23-24H,1-2H3;/b9-7-,10-8-;
InChIKey	ZQADQFRYAJKZQB-RMMOYNDYSA-N Google Search
Mol Weight	443.837 g/mol
Molecular Formula	C16H14CuF6N2O2
Exact Mass	443.025544 g/mol

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SpectraBase Spectrum ID	CAnhAVW0Fe
Name	copper; (Z)-1,1,1-trifluoro-4-[2-[[(Z)-5,5,5-trifluoro-4-oxopent-2-en-2-yl]amino]anilino]pent-3-en-2-one
CAS Registry Number	88007-88-9
Comments	Note: The molecular formula of the structure shown is C16H14CuF6N2O2 - which differs from the formula reported for the mass spectrum (C16H12CuF6N2O2)
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H12CuF6N2O2
InChI	InChI=1S/C16H14F6N2O2.Cu/c1-9(7-13(25)15(17,18)19)23-11-5-3-4-6-12(11)24-10(2)8-14(26)16(20,21)22;/h3-8,23-24H,1-2H3;/b9-7-,10-8-;
InChIKey	ZQADQFRYAJKZQB-RMMOYNDYSA-N
Molecular Weight	443.837 g/mol
SMILES	N(\C(C)=C/C(=O)C(F)(F)F)c1ccccc1N\C(C)=C/C(=O)C(F)(F)F.[Cu]
SPLASH	splash10-004i-2590000000-87a3bebc304bd437ac7f
Source of Spectrum	W5-1989-35480-30056
Synonyms	copper;(Z)-1,1,1-trifluoro-4-[2-[[(Z)-5,5,5-trifluoro-4-oxopent-2-en-2-yl]amino]anilino]-3-penten-2-one copper;(Z)-1,1,1-trifluoro-4-[2-[[(Z)-5,5,5-trifluoro-4-oxopent-2-en-2-yl]amino]anilino]pent-3-en-2-one copper;(Z)-1,1,1-trifluoro-4-[2-[[(Z)-4,4,4-trifluoro-1-methyl-3-oxo-but-1-enyl]amino]anilino]pent-3-en-2-one copper;(Z)-1,1,1-tris(fluoranyl)-4-[[2-[[(Z)-5,5,5-tris(fluoranyl)-4-oxidanylidene-pent-2-en-2-yl]amino]phenyl]amino]pent-3-en-2-one
Wiley ID	1384998