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

*Links on SpectraBase are not permalinks.
Ethyl 3-(6,7-Dimethoxy-2H-1,3-benzodioxol-5-yl)-4-phenyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID HLZkydO2IBV
InChI InChI=1S/C22H21NO6/c1-4-27-22(24)18-17(15(11-23-18)13-8-6-5-7-9-13)14-10-16-20(29-12-28-16)21(26-3)19(14)25-2/h5-11,23H,4,12H2,1-3H3
InChIKey IILOQBYFQZUDBF-UHFFFAOYSA-N
Mol Weight 395.41 g/mol
Molecular Formula C22H21NO6
Exact Mass 395.136887 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 FENeNa5ZZhg
Name Ethyl 3-(6,7-Dimethoxy-2H-1,3-benzodioxol-5-yl)-4-phenyl-1H-pyrrole-2-carboxylate
Appearance Yellowish solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO6
InChI InChI=1S/C22H21NO6/c1-4-27-22(24)18-17(15(11-23-18)13-8-6-5-7-9-13)14-10-16-20(29-12-28-16)21(26-3)19(14)25-2/h5-11,23H,4,12H2,1-3H3
InChIKey IILOQBYFQZUDBF-UHFFFAOYSA-N
Instrument Name Finnigan MAT-INCOS 50
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000099
Molecular Weight 395.411 g/mol
SMILES [nH]1cc(c(c1C(=O)OCC)-c1cc2c(c(c1OC)OC)OCO2)-c1ccccc1
SPLASH splash10-0002-1009000000-8e1dfac0692693e44b86
Source of Spectrum U1-2020-2098-5f
Wiley ID 1860470