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1-Benzyl-5-methoxy-2-vinyl-indole-3-carboxylic acid methyl ester

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

1-Benzyl-5-methoxy-2-vinyl-indole-3-carboxylic acid methyl ester
SpectraBase Compound ID 52FiFgJNtsc
InChI InChI=1S/C20H19NO3/c1-4-17-19(20(22)24-3)16-12-15(23-2)10-11-18(16)21(17)13-14-8-6-5-7-9-14/h4-12H,1,13H2,2-3H3
InChIKey DCZPIIONBUJDLG-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDyrQZMU1RC
Name 1-Benzyl-5-methoxy-2-vinyl-indole-3-carboxylic acid methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.136493473 u
Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-4-17-19(20(22)24-3)16-12-15(23-2)10-11-18(16)21(17)13-14-8-6-5-7-9-14/h4-12H,1,13H2,2-3H3
InChIKey DCZPIIONBUJDLG-UHFFFAOYSA-N
Molecular Weight 321.376 g/mol
SMILES C=1(N(C=2C=CC(=CC2C1C(=O)OC)OC)CC=1C=CC=CC1)C=C