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Ethyl 2-methyl-1-phenethyl-5-phenyl-1H-pyrrole-3-carboxylate

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

Ethyl 2-methyl-1-phenethyl-5-phenyl-1H-pyrrole-3-carboxylate
SpectraBase Compound ID K1Ghcci9k2O
InChI InChI=1S/C22H23NO2/c1-3-25-22(24)20-16-21(19-12-8-5-9-13-19)23(17(20)2)15-14-18-10-6-4-7-11-18/h4-13,16H,3,14-15H2,1-2H3
InChIKey AHCNHBPCTBGBMB-UHFFFAOYSA-N
Mol Weight 333.43 g/mol
Molecular Formula C22H23NO2
Exact Mass 333.172879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2tvLCYnF9Lh
Name Ethyl 2-methyl-1-phenethyl-5-phenyl-1H-pyrrole-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.172878983 u
Formula C22H23NO2
InChI InChI=1S/C22H23NO2/c1-3-25-22(24)20-16-21(19-12-8-5-9-13-19)23(17(20)2)15-14-18-10-6-4-7-11-18/h4-13,16H,3,14-15H2,1-2H3
InChIKey AHCNHBPCTBGBMB-UHFFFAOYSA-N
Molecular Weight 333.431 g/mol
SMILES C=1(N(C(=CC1C(OCC)=O)C1=CC=CC=C1)CCC1=CC=CC=C1)C