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3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-(1-oxopropyl)-1-cyclohex-2-enone
SpectraBase Compound ID 3KBPQChdWfJ
InChI InChI=1S/C21H23F3N2O3/c1-3-18(27)20-17(5-4-6-19(20)28)25-10-9-14-12(2)26-16-8-7-13(11-15(14)16)29-21(22,23)24/h7-8,11,25-26H,3-6,9-10H2,1-2H3
InChIKey IJLCQLHEYNFARK-UHFFFAOYSA-N
Mol Weight 408.42 g/mol
Molecular Formula C21H23F3N2O3
Exact Mass 408.166077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbRslqjzmW5
Name 3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-(1-oxopropyl)-1-cyclohex-2-enone
Alternate Name(s) 3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-propanoyl-cyclohex-2-en-1-one 3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-propionyl-cyclohex-2-en-1-one 3-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethylamino]-2-propanoyl-cyclohex-2-en-1-one
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Formula C21H23F3N2O3
InChI InChI=1S/C21H23F3N2O3/c1-3-18(27)20-17(5-4-6-19(20)28)25-10-9-14-12(2)26-16-8-7-13(11-15(14)16)29-21(22,23)24/h7-8,11,25-26H,3-6,9-10H2,1-2H3
InChIKey IJLCQLHEYNFARK-UHFFFAOYSA-N
Molecular Weight 408.421 g/mol
SMILES N(C1=C(C(=O)CCC1)C(=O)CC)CCc1c([nH]c2c1cc(cc2)OC(F)(F)F)C
SPLASH splash10-004i-3970100000-7a567da9d94b1d65e1a1
Wiley ID 1445161