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4-Benzyl 2-ethyl 1,5-dimethyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate

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

4-Benzyl 2-ethyl 1,5-dimethyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate
SpectraBase Compound ID 7NFbQZ8ozIE
InChI InChI=1S/C23H23NO4/c1-4-27-23(26)21-20(18-13-9-6-10-14-18)19(16(2)24(21)3)22(25)28-15-17-11-7-5-8-12-17/h5-14H,4,15H2,1-3H3
InChIKey RPZOICUPOVTWGR-UHFFFAOYSA-N
Mol Weight 377.44 g/mol
Molecular Formula C23H23NO4
Exact Mass 377.162708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9K3ThC8dO6I
Name 4-Benzyl 2-ethyl 1,5-dimethyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 377.162708221 u
Formula C23H23NO4
InChI InChI=1S/C23H23NO4/c1-4-27-23(26)21-20(18-13-9-6-10-14-18)19(16(2)24(21)3)22(25)28-15-17-11-7-5-8-12-17/h5-14H,4,15H2,1-3H3
InChIKey RPZOICUPOVTWGR-UHFFFAOYSA-N
Molecular Weight 377.440 g/mol
SMILES C=1(C(=C(C(=O)OCC)N(C1C)C)C=1C=CC=CC1)C(OCC=1C=CC=CC1)=O