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2-[1-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]pentylidene]cyclohexane-1,3-dione
SpectraBase Compound ID D7qKYdR5oox
InChI InChI=1S/C23H27F3N2O3/c1-3-4-6-19(22-20(29)7-5-8-21(22)30)27-12-11-16-14(2)28-18-10-9-15(13-17(16)18)31-23(24,25)26/h9-10,13,27-28H,3-8,11-12H2,1-2H3
InChIKey BHBCTKGYSXMASL-UHFFFAOYSA-N
Mol Weight 436.48 g/mol
Molecular Formula C23H27F3N2O3
Exact Mass 436.197377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UDoBvqRnOR
Name 2-[1-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]pentylidene]cyclohexane-1,3-dione
Alternate Name(s) 2-[1-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]pentylidene]cyclohexane-1,3-quinone 2-[1-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethylamino]pentylidene]cyclohexane-1,3-dione
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Formula C23H27F3N2O3
InChI InChI=1S/C23H27F3N2O3/c1-3-4-6-19(22-20(29)7-5-8-21(22)30)27-12-11-16-14(2)28-18-10-9-15(13-17(16)18)31-23(24,25)26/h9-10,13,27-28H,3-8,11-12H2,1-2H3
InChIKey BHBCTKGYSXMASL-UHFFFAOYSA-N
Molecular Weight 436.475 g/mol
SMILES N(C(=C1C(=O)CCCC1=O)CCCC)CCc1c([nH]c2c1cc(cc2)OC(F)(F)F)C
SPLASH splash10-056u-2590100000-a0151b6e268530a790b8
Wiley ID 1445149