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(2E)-1-(9-Anthryl)-3-(2-chloro-6-methoxyquinolin-3-yl)prop-2-en-1-one
SpectraBase Compound ID 5MfjeJLcCMe
InChI InChI=1S/C27H18ClNO2/c1-31-21-11-12-24-20(16-21)15-19(27(28)29-24)10-13-25(30)26-22-8-4-2-6-17(22)14-18-7-3-5-9-23(18)26/h2-16H,1H3/b13-10+
InChIKey DLILFRWKYLSEAH-JLHYYAGUSA-N
Mol Weight 423.9 g/mol
Molecular Formula C27H18ClNO2
Exact Mass 423.102607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Lbkf61tW8i
Name (2E)-1-(9-Anthryl)-3-(2-chloro-6-methoxyquinolin-3-yl)prop-2-en-1-one
Alternate Name(s) (E)-1-(9-anthracenyl)-3-(2-chloro-6-methoxy-3-quinolinyl)-2-propen-1-one (E)-1-anthracen-9-yl-3-(2-chloro-6-methoxyquinolin-3-yl)prop-2-en-1-one (E)-1-anthracen-9-yl-3-(2-chloranyl-6-methoxy-quinolin-3-yl)prop-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C27H18ClNO2
InChI InChI=1S/C27H18ClNO2/c1-31-21-11-12-24-20(16-21)15-19(27(28)29-24)10-13-25(30)26-22-8-4-2-6-17(22)14-18-7-3-5-9-23(18)26/h2-16H,1H3/b13-10+
InChIKey DLILFRWKYLSEAH-JLHYYAGUSA-N
Molecular Weight 423.899 g/mol
SMILES c1(nc2c(cc1\C=C\C(c1c3c(cccc3)cc3c1cccc3)=O)cc(cc2)OC)Cl
SPLASH splash10-004i-0900200000-75044a60ccd8e45673e7
Source of Spectrum E1-58-305-2s
Wiley ID 1661806