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4-N-benzyl-6-morpholin-4-yl-2-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]-1,3,5-triazine-2,4-diamine
SpectraBase Compound ID EErKrsLmv79
InChI InChI=1S/C22H22F3N7O/c23-22(24,25)18-9-5-4-8-17(18)15-27-31-20-28-19(26-14-16-6-2-1-3-7-16)29-21(30-20)32-10-12-33-13-11-32/h1-9,15H,10-14H2,(H2,26,28,29,30,31)/b27-15+
InChIKey SQLBMLFQBJBGCI-JFLMPSFJSA-N
Mol Weight 457.46 g/mol
Molecular Formula C22H22F3N7O
Exact Mass 457.183793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUO93x6WrJm
Name 4-N-benzyl-6-morpholin-4-yl-2-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]-1,3,5-triazine-2,4-diamine
Alternate Name(s) 6-(4-morpholinyl)-N4-(phenylmethyl)-N2-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]-1,3,5-triazine-2,4-diamine 6-morpholin-4-yl-N4-(phenylmethyl)-N2-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]-1,3,5-triazine-2,4-diamine benzyl-[4-morpholino-6-[(N'E)-N'-[2-(trifluoromethyl)benzylidene]hydrazino]-s-triazin-2-yl]amine N4-benzyl-6-morpholino-N2-[(E)-[2-(trifluoromethyl)phenyl]methyleneamino]-1,3,5-triazine-2,4-diamine
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Formula C22H22F3N7O
InChI InChI=1S/C22H22F3N7O/c23-22(24,25)18-9-5-4-8-17(18)15-27-31-20-28-19(26-14-16-6-2-1-3-7-16)29-21(30-20)32-10-12-33-13-11-32/h1-9,15H,10-14H2,(H2,26,28,29,30,31)/b27-15+
InChIKey SQLBMLFQBJBGCI-JFLMPSFJSA-N
Molecular Weight 457.461 g/mol
SMILES N(c1nc(nc(n1)N1CCOCC1)N\N=C\c1c(C(F)(F)F)cccc1)Cc1ccccc1
SPLASH splash10-0006-9420000000-4296c720f10f536cdc7d
Wiley ID 1446684