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(2E)-1-(5-Bromothien-2-yl)-3-(2-chloro-6-methylquinolin-3-yl)prop-2-en-1-one
SpectraBase Compound ID 5ZaY9Ds3UzQ
InChI InChI=1S/C17H11BrClNOS/c1-10-2-4-13-12(8-10)9-11(17(19)20-13)3-5-14(21)15-6-7-16(18)22-15/h2-9H,1H3/b5-3+
InChIKey PHCDZVPVXPRTIT-HWKANZROSA-N
Mol Weight 392.7 g/mol
Molecular Formula C17H11BrClNOS
Exact Mass 390.943326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fgg6znC5wcD
Name (2E)-1-(5-Bromothien-2-yl)-3-(2-chloro-6-methylquinolin-3-yl)prop-2-en-1-one
Alternate Name(s) (E)-1-(5-bromo-2-thiophenyl)-3-(2-chloro-6-methyl-3-quinolinyl)-2-propen-1-one (E)-1-(5-bromothiophen-2-yl)-3-(2-chloro-6-methylquinolin-3-yl)prop-2-en-1-one (E)-1-(5-bromanylthiophen-2-yl)-3-(2-chloranyl-6-methyl-quinolin-3-yl)prop-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C17H11BrClNOS
InChI InChI=1S/C17H11BrClNOS/c1-10-2-4-13-12(8-10)9-11(17(19)20-13)3-5-14(21)15-6-7-16(18)22-15/h2-9H,1H3/b5-3+
InChIKey PHCDZVPVXPRTIT-HWKANZROSA-N
Molecular Weight 392.698 g/mol
SMILES c1(nc2c(cc1\C=C\C(c1sc(Br)cc1)=O)cc(cc2)C)Cl
SPLASH splash10-0a4i-0009000000-ffe373cbb52346fc3b5c
Source of Spectrum E1-58-304-1j
Wiley ID 1661833