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2,6-bis(diethylaminomethyl)-3-methyl-4-(7'-trifluoromethylquinolin-4'-ylamino)phenol
SpectraBase Compound ID JxFpqGtPZr6
InChI InChI=1S/C27H35F3N4O/c1-6-33(7-2)16-19-14-24(18(5)22(26(19)35)17-34(8-3)9-4)32-23-12-13-31-25-15-20(27(28,29)30)10-11-21(23)25/h10-15,35H,6-9,16-17H2,1-5H3,(H,31,32)
InChIKey IMKLKFTXOTWIHI-UHFFFAOYSA-N
Mol Weight 488.6 g/mol
Molecular Formula C27H35F3N4O
Exact Mass 488.276296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBOmwRNSZfa
Name 2,6-bis(diethylaminomethyl)-3-methyl-4-(7'-trifluoromethylquinolin-4'-ylamino)phenol
Comments Less than 3 mono-isotopic peaks
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Formula C27H35F3N4O
InChI InChI=1S/C27H35F3N4O/c1-6-33(7-2)16-19-14-24(18(5)22(26(19)35)17-34(8-3)9-4)32-23-12-13-31-25-15-20(27(28,29)30)10-11-21(23)25/h10-15,35H,6-9,16-17H2,1-5H3,(H,31,32)
InChIKey IMKLKFTXOTWIHI-UHFFFAOYSA-N
Molecular Weight 488.599 g/mol
SMILES N(c1cc(c(c(c1C)CN(CC)CC)O)CN(CC)CC)c1c2c(cc(C(F)(F)F)cc2)ncc1
SPLASH splash10-0a4i-0000900000-5022c7f2c1126aa73705
Source of Spectrum B-44-151-0
Synonyms 2,6-bis[(diethylamino)methyl]-3-methyl-4-{[7-(trifluoromethyl)-4-quinolinyl]amino}phenol
Wiley ID 1396877