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Methyl (E)-3-(1H-indol-3-yl)-2-(2-methyl-5-phenyl-3-styryl-1H-pyrrol-1-yl)propanoate

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

Methyl (E)-3-(1H-indol-3-yl)-2-(2-methyl-5-phenyl-3-styryl-1H-pyrrol-1-yl)propanoate
SpectraBase Compound ID 3DszNdViMBa
InChI InChI=1S/C31H28N2O2/c1-22-25(18-17-23-11-5-3-6-12-23)19-29(24-13-7-4-8-14-24)33(22)30(31(34)35-2)20-26-21-32-28-16-10-9-15-27(26)28/h3-19,21,30,32H,20H2,1-2H3/b18-17+
InChIKey YJHHEERSVLZQTP-ISLYRVAYSA-N
Mol Weight 460.58 g/mol
Molecular Formula C31H28N2O2
Exact Mass 460.215078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GVsAOZveAl2
Name Methyl (E)-3-(1H-indol-3-yl)-2-(2-methyl-5-phenyl-3-styryl-1H-pyrrol-1-yl)propanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.215078148 u
Formula C31H28N2O2
InChI InChI=1S/C31H28N2O2/c1-22-25(18-17-23-11-5-3-6-12-23)19-29(24-13-7-4-8-14-24)33(22)30(31(34)35-2)20-26-21-32-28-16-10-9-15-27(26)28/h3-19,21,30,32H,20H2,1-2H3/b18-17+
InChIKey YJHHEERSVLZQTP-ISLYRVAYSA-N
Molecular Weight 460.577 g/mol
SMILES C=1(N(C(=C(C1)\C=C\C=1C=CC=CC1)C)C(CC1=CNC=2C1=CC=CC2)C(=O)OC)C1=CC=CC=C1