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1-[4-(4-fluorophenyl)-3-(1H-indol-3-yl)-2-(4-methylphenyl)-3H-1,2,4-triazol-5-yl]ethanone

View entire compound with spectra: 1 MS (GC)

1-[4-(4-fluorophenyl)-3-(1H-indol-3-yl)-2-(4-methylphenyl)-3H-1,2,4-triazol-5-yl]ethanone
SpectraBase Compound ID KJzz0XhCTns
InChI InChI=1S/C25H21FN4O/c1-16-7-11-20(12-8-16)30-25(22-15-27-23-6-4-3-5-21(22)23)29(24(28-30)17(2)31)19-13-9-18(26)10-14-19/h3-15,25,27H,1-2H3
InChIKey BLOIOEJSTVAHGU-UHFFFAOYSA-N
Mol Weight 412.47 g/mol
Molecular Formula C25H21FN4O
Exact Mass 412.169939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKQVTSEN0s6
Name 1-[4-(4-fluorophenyl)-3-(1H-indol-3-yl)-2-(4-methylphenyl)-3H-1,2,4-triazol-5-yl]ethanone
Alternate Name(s) 1-[4-(4-fluorophenyl)-3-(1H-indol-3-yl)-2-(p-tolyl)-3H-1,2,4-triazol-5-yl]ethanone 1-[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-1-(4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
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Formula C25H21FN4O
InChI InChI=1S/C25H21FN4O/c1-16-7-11-20(12-8-16)30-25(22-15-27-23-6-4-3-5-21(22)23)29(24(28-30)17(2)31)19-13-9-18(26)10-14-19/h3-15,25,27H,1-2H3
InChIKey BLOIOEJSTVAHGU-UHFFFAOYSA-N
Molecular Weight 412.468 g/mol
SMILES [nH]1c2c(c(c1)C1N(C(=NN1c1ccc(cc1)C)C(=O)C)c1ccc(cc1)F)cccc2
SPLASH splash10-001l-9570200000-4d7dff59907ab871cde5
Wiley ID 1457808