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(2E)-3-(2-Chloro-6-methylquinolin-3-yl)-1-(5-iodothien-2-yl)prop-2-en-1-one
SpectraBase Compound ID Ky4eeylnuFt
InChI InChI=1S/C17H11ClINOS/c1-10-2-4-13-12(8-10)9-11(17(18)20-13)3-5-14(21)15-6-7-16(19)22-15/h2-9H,1H3/b5-3+
InChIKey NVXCGLNTFZRWGW-HWKANZROSA-N
Mol Weight 439.7 g/mol
Molecular Formula C17H11ClINOS
Exact Mass 438.929458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77JR7N2qIKo
Name (2E)-3-(2-Chloro-6-methylquinolin-3-yl)-1-(5-iodothien-2-yl)prop-2-en-1-one
Alternate Name(s) (E)-3-(2-chloro-6-methyl-3-quinolinyl)-1-(5-iodo-2-thiophenyl)-2-propen-1-one (E)-3-(2-chloro-6-methylquinolin-3-yl)-1-(5-iodothiophen-2-yl)prop-2-en-1-one (E)-3-(2-chloranyl-6-methyl-quinolin-3-yl)-1-(5-iodanylthiophen-2-yl)prop-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C17H11ClINOS
InChI InChI=1S/C17H11ClINOS/c1-10-2-4-13-12(8-10)9-11(17(18)20-13)3-5-14(21)15-6-7-16(19)22-15/h2-9H,1H3/b5-3+
InChIKey NVXCGLNTFZRWGW-HWKANZROSA-N
Molecular Weight 439.698 g/mol
SMILES c1(nc2c(cc1\C=C\C(c1sc(I)cc1)=O)cc(cc2)C)Cl
SPLASH splash10-0udi-0000900000-7b5bbfbbb08b521fb3ae
Source of Spectrum E1-58-304-1k
Wiley ID 1661832