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3-(,alpha.-Aminobenzyl)-5-methyl-2-phenyl-1-(p-tolyl)pyrrole

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

3-(,alpha.-Aminobenzyl)-5-methyl-2-phenyl-1-(p-tolyl)pyrrole
SpectraBase Compound ID 8bhUT6jzPVa
InChI InChI=1S/C25H24N2/c1-18-13-15-22(16-14-18)27-19(2)17-23(24(26)20-9-5-3-6-10-20)25(27)21-11-7-4-8-12-21/h3-17,24H,26H2,1-2H3
InChIKey FMYAPYXGEAXVRD-UHFFFAOYSA-N
Mol Weight 352.48 g/mol
Molecular Formula C25H24N2
Exact Mass 352.193949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EEeMK5QqxJA
Name 3-(,alpha.-Aminobenzyl)-5-methyl-2-phenyl-1-(p-tolyl)pyrrole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.193948781 u
Formula C25H24N2
InChI InChI=1S/C25H24N2/c1-18-13-15-22(16-14-18)27-19(2)17-23(24(26)20-9-5-3-6-10-20)25(27)21-11-7-4-8-12-21/h3-17,24H,26H2,1-2H3
InChIKey FMYAPYXGEAXVRD-UHFFFAOYSA-N
Molecular Weight 352.481 g/mol
SMILES C1(=C(N(C2=CC=C(C=C2)C)C(=C1)C)C=1C=CC=CC1)C(C1=CC=CC=C1)N