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Indole-3-carboxylic acid, 5-methoxy-2-methyl-1-(3-methylphenyl)-, ethyl ester

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Indole-3-carboxylic acid, 5-methoxy-2-methyl-1-(3-methylphenyl)-, ethyl ester
SpectraBase Compound ID CsBl32g2bQQ
InChI InChI=1S/C20H21NO3/c1-5-24-20(22)19-14(3)21(15-8-6-7-13(2)11-15)18-10-9-16(23-4)12-17(18)19/h6-12H,5H2,1-4H3
InChIKey KLPJDTQEUFEICQ-UHFFFAOYSA-N
Mol Weight 323.39 g/mol
Molecular Formula C20H21NO3
Exact Mass 323.152144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ElDvg7h7G4m
Name Indole-3-carboxylic acid, 5-methoxy-2-methyl-1-(3-methylphenyl)-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 323.152143537 u
Formula C20H21NO3
InChI InChI=1S/C20H21NO3/c1-5-24-20(22)19-14(3)21(15-8-6-7-13(2)11-15)18-10-9-16(23-4)12-17(18)19/h6-12H,5H2,1-4H3
InChIKey KLPJDTQEUFEICQ-UHFFFAOYSA-N
Molecular Weight 323.392 g/mol
SMILES C1(=C(N(C2=CC(C)=CC=C2)C2=C1C=C(OC)C=C2)C)C(=O)OCC