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N-[2-(2-Methyl-1H-indol-3-yl)-ethyl]-terephthalamic acid methyl ester
SpectraBase Compound ID HJfO6vo68lo
InChI InChI=1S/C20H20N2O3/c1-13-16(17-5-3-4-6-18(17)22-13)11-12-21-19(23)14-7-9-15(10-8-14)20(24)25-2/h3-10,22H,11-12H2,1-2H3,(H,21,23)
InChIKey LMDJLCLBOCXAMO-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YdgGDtti7M
Name N-[2-(2-Methyl-1H-indol-3-yl)-ethyl]-terephthalamic acid methyl ester
Alternate Name(s) 4-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]benzoic acid methyl ester 4-[[2-(2-methyl-1H-indol-3-yl)ethylamino]-oxomethyl]benzoic acid methyl ester Methyl 4-(([2-(2-methyl-1H-indol-3-yl)ethyl]amino)carbonyl)benzoate Methyl 4-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]benzoate
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Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-13-16(17-5-3-4-6-18(17)22-13)11-12-21-19(23)14-7-9-15(10-8-14)20(24)25-2/h3-10,22H,11-12H2,1-2H3,(H,21,23)
InChIKey LMDJLCLBOCXAMO-UHFFFAOYSA-N
Molecular Weight 336.391 g/mol
SMILES [nH]1c2c(c(CCNC(c3ccc(C(=O)OC)cc3)=O)c1C)cccc2
SPLASH splash10-0006-0900000000-24148462b0a9951a37bd
Wiley ID 1462483