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1H-indole-3-ethanamine, N-[(2,4-dichlorophenyl)[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]methyl]-2-methyl-
SpectraBase Compound ID LnVIHbcN37f
InChI InChI=1S/C27H26Cl2N6/c1-16-7-6-8-17(2)26(16)35-27(32-33-34-35)25(22-12-11-19(28)15-23(22)29)30-14-13-20-18(3)31-24-10-5-4-9-21(20)24/h4-12,15,25,30-31H,13-14H2,1-3H3
InChIKey DXVNAFYMHMNQCU-UHFFFAOYSA-N
Mol Weight 505.45 g/mol
Molecular Formula C27H26Cl2N6
Exact Mass 504.1596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DD9OABfFxdc
Name N-[(2,4-dichlorophenyl)-[1-(2,6-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-2-(2-methyl-1H-indol-3-yl)ethanamine
Alternate Name(s) N-[(2,4-dichlorophenyl)-[1-(2,6-dimethylphenyl)-5-tetrazolyl]methyl]-2-(2-methyl-1H-indol-3-yl)ethanamine N-[(2,4-dichlorophenyl)-[1-(2,6-dimethylphenyl)tetrazol-5-yl]methyl]-2-(2-methyl-1H-indol-3-yl)ethanamine [(2,4-dichlorophenyl)-[1-(2,6-dimethylphenyl)tetrazol-5-yl]methyl]-[2-(2-methyl-1H-indol-3-yl)ethyl]amine
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Formula C27H26Cl2N6
InChI InChI=1S/C27H26Cl2N6/c1-16-7-6-8-17(2)26(16)35-27(32-33-34-35)25(22-12-11-19(28)15-23(22)29)30-14-13-20-18(3)31-24-10-5-4-9-21(20)24/h4-12,15,25,30-31H,13-14H2,1-3H3
InChIKey DXVNAFYMHMNQCU-UHFFFAOYSA-N
Molecular Weight 505.453 g/mol
SMILES [nH]1c2c(c(CCNC(c3[n](nnn3)-c3c(cccc3C)C)c3c(cc(cc3)Cl)Cl)c1C)cccc2
SPLASH splash10-052g-1900000000-679aceac7e4817e671a2
Wiley ID 1466286