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4-[(7-chloranylquinolin-4-yl)amino]-2-(diethylaminomethyl)-3,5,6-tris(fluoranyl)phenol
SpectraBase Compound ID JRzNZzzMI9d
InChI InChI=1S/C20H19ClF3N3O/c1-3-27(4-2)10-13-16(22)19(17(23)18(24)20(13)28)26-14-7-8-25-15-9-11(21)5-6-12(14)15/h5-9,28H,3-4,10H2,1-2H3,(H,25,26)
InChIKey PQBLBDFJROEZLD-UHFFFAOYSA-N
Mol Weight 409.84 g/mol
Molecular Formula C20H19ClF3N3O
Exact Mass 409.116874 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1HyVMmIzc6
Name 4-[(7-chloranylquinolin-4-yl)amino]-2-(diethylaminomethyl)-3,5,6-tris(fluoranyl)phenol
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Formula C20H19ClF3N3O
InChI InChI=1S/C20H19ClF3N3O/c1-3-27(4-2)10-13-16(22)19(17(23)18(24)20(13)28)26-14-7-8-25-15-9-11(21)5-6-12(14)15/h5-9,28H,3-4,10H2,1-2H3,(H,25,26)
InChIKey PQBLBDFJROEZLD-UHFFFAOYSA-N
Molecular Weight 409.840 g/mol
SMILES Oc1c(c(c(c(c1CN(CC)CC)F)Nc1c2c(cc(cc2)Cl)ncc1)F)F
SPLASH splash10-0a4i-9000100000-10e8358757f19ff50e17
Source of Spectrum E1-37-1370-6
Synonyms 4-[(7-chloro-4-quinolyl)amino]-2-(diethylaminomethyl)-3,5,6-trifluoro-phenol 4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)-3,5,6-trifluorophenol
Wiley ID 1575076