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2-Methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
SpectraBase Compound ID CYqO1p5Eq5K
InChI InChI=1S/C17H15Cl3N2O3/c1-10-13(9-17(18,19)20)16-14(3-2-4-15(16)23)21(10)11-5-7-12(8-6-11)22(24)25/h5-8H,2-4,9H2,1H3
InChIKey FNNNEWCYVTXSAL-UHFFFAOYSA-N
Mol Weight 401.68 g/mol
Molecular Formula C17H15Cl3N2O3
Exact Mass 400.014825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yr0Z7Ry33f
Name 2-Methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Alternate Name(s) 2-Methyl-1-(4-nitrophenyl)-3-(2,2,2-trichloroethyl)-6,7-dihydro-5H-indol-4-one 2-Methyl-1-(4-nitrophenyl)-3-[2,2,2-tris(chloranyl)ethyl]-6,7-dihydro-5H-indol-4-one
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Formula C17H15Cl3N2O3
InChI InChI=1S/C17H15Cl3N2O3/c1-10-13(9-17(18,19)20)16-14(3-2-4-15(16)23)21(10)11-5-7-12(8-6-11)22(24)25/h5-8H,2-4,9H2,1H3
InChIKey FNNNEWCYVTXSAL-UHFFFAOYSA-N
Molecular Weight 401.677 g/mol
SMILES c12c(c(C)[n](c2CCCC1=O)-c1ccc(N(=O)=O)cc1)CC(Cl)(Cl)Cl
SPLASH splash10-001i-2294000000-6e4f523ff7733e3e96f0
Wiley ID 1458435