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(E)-1-(4-chlorophenyl)-3-(1-phenyl-2-sulfanylidene-3-pyridinyl)-2-propen-1-one
SpectraBase Compound ID DfUQ9tiwrQ0
InChI InChI=1S/C20H14ClNOS/c21-17-11-8-15(9-12-17)19(23)13-10-16-5-4-14-22(20(16)24)18-6-2-1-3-7-18/h1-14H/b13-10+
InChIKey GWKQNYDKOJCJQZ-JLHYYAGUSA-N
Mol Weight 351.85 g/mol
Molecular Formula C20H14ClNOS
Exact Mass 351.048463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5iruXdwY3Yz
Name (E)-1-(4-chlorophenyl)-3-(1-phenyl-2-sulfanylidene-3-pyridinyl)-2-propen-1-one
Alternate Name(s) (E)-1-(4-chlorophenyl)-3-(1-phenyl-2-sulfanylidene-pyridin-3-yl)prop-2-en-1-one (E)-1-(4-chlorophenyl)-3-(1-phenyl-2-thioxo-3-pyridyl)prop-2-en-1-one
CAS Registry Number 89817-97-0
Comments Less than 3 mono-isotopic peaks
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Formula C20H14ClNOS
InChI InChI=1S/C20H14ClNOS/c21-17-11-8-15(9-12-17)19(23)13-10-16-5-4-14-22(20(16)24)18-6-2-1-3-7-18/h1-14H/b13-10+
InChIKey GWKQNYDKOJCJQZ-JLHYYAGUSA-N
Molecular Weight 351.851 g/mol
SMILES C1(N(C=CC=C1\C=C\C(c1ccc(cc1)Cl)=O)c1ccccc1)=S
SPLASH splash10-03di-0090000000-412f1b40d23d999ba77e
Source of Spectrum Y-20-1653-0
Wiley ID 1342614