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Ethyl 5-(benzyloxy)-1-(2-propenyl)-1H-indole-2-carboxylate

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

Ethyl 5-(benzyloxy)-1-(2-propenyl)-1H-indole-2-carboxylate
SpectraBase Compound ID 4M4kLExf3co
InChI InChI=1S/C21H21NO3/c1-3-12-22-19-11-10-18(25-15-16-8-6-5-7-9-16)13-17(19)14-20(22)21(23)24-4-2/h3,5-11,13-14H,1,4,12,15H2,2H3
InChIKey IMRRVKSCPVTRHF-UHFFFAOYSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1WNK3WB6xqZ
Name Ethyl 5-(benzyloxy)-1-(2-propenyl)-1H-indole-2-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 335.152143537 u
Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-3-12-22-19-11-10-18(25-15-16-8-6-5-7-9-16)13-17(19)14-20(22)21(23)24-4-2/h3,5-11,13-14H,1,4,12,15H2,2H3
InChIKey IMRRVKSCPVTRHF-UHFFFAOYSA-N
Molecular Weight 335.403 g/mol
SMILES C=1(N(C=2C=CC(=CC2C1)OCC1=CC=CC=C1)CC=C)C(=O)OCC