For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Ethyl 5-(2-benzyl-5-methoxyphenyl)-1H-pyrrole-3-carboxylate
SpectraBase Compound ID Bb8S6R0mMIJ
InChI InChI=1S/C21H21NO3/c1-3-25-21(23)17-12-20(22-14-17)19-13-18(24-2)10-9-16(19)11-15-7-5-4-6-8-15/h4-10,12-14,22H,3,11H2,1-2H3
InChIKey MTEGMCVCOCDNEP-UHFFFAOYSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Hwlg7yGcVJE
Name Ethyl 5-(2-benzyl-5-methoxyphenyl)-1H-pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-3-25-21(23)17-12-20(22-14-17)19-13-18(24-2)10-9-16(19)11-15-7-5-4-6-8-15/h4-10,12-14,22H,3,11H2,1-2H3
InChIKey MTEGMCVCOCDNEP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.orglett.6b00141
Molecular Weight 335.403 g/mol
SMILES [nH]1c(cc(c1)C(=O)OCC)-c1c(ccc(c1)OC)Cc1ccccc1
SPLASH splash10-000i-1039000000-cc1571919154b84c6e77
Source of Spectrum A1-18-852/SM24-9c
Wiley ID 1805213