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

*Links on SpectraBase are not permalinks.
(E)-3-[1-(2,6-dichlorobenzoyl)-5-[(E)-3-ethoxy-3-keto-prop-1-enyl]pyrrol-2-yl]acrylic acid ethyl ester
SpectraBase Compound ID GQk6FiSbsV6
InChI InChI=1S/C21H19Cl2NO5/c1-3-28-18(25)12-10-14-8-9-15(11-13-19(26)29-4-2)24(14)21(27)20-16(22)6-5-7-17(20)23/h5-13H,3-4H2,1-2H3/b12-10+,13-11+
InChIKey ZEUKNDRUGPHBQN-DCIPZJNNSA-N
Mol Weight 436.29 g/mol
Molecular Formula C21H19Cl2NO5
Exact Mass 435.064028 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 GyuquauQ80W
Name (E)-3-[1-(2,6-dichlorobenzoyl)-5-[(E)-3-ethoxy-3-keto-prop-1-enyl]pyrrol-2-yl]acrylic acid ethyl ester
CAS Registry Number 95883-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19Cl2NO5
InChI InChI=1S/C21H19Cl2NO5/c1-3-28-18(25)12-10-14-8-9-15(11-13-19(26)29-4-2)24(14)21(27)20-16(22)6-5-7-17(20)23/h5-13H,3-4H2,1-2H3/b12-10+,13-11+
InChIKey ZEUKNDRUGPHBQN-DCIPZJNNSA-N
Molecular Weight 436.291 g/mol
SMILES CCOC(=O)\C=C\c1ccc(\C=C\C(=O)OCC)[n]1C(=O)c1c(Cl)cccc1Cl
SPLASH splash10-00fr-0900000000-7f5d5f42b90ee81ef386
Source of Spectrum W5-1989-38458-27078
Synonyms (E)-3-[1-[(2,6-dichlorophenyl)-oxomethyl]-5-[(E)-3-ethoxy-3-oxoprop-1-enyl]-2-pyrrolyl]-2-propenoic acid ethyl ester Diethyl 3,3'-[1-(2,6-dichlorobenzoyl)pyrrole-2,5-diyl]diprop-2-enoate Ethyl (E)-3-[1-(2,6-dichlorobenzoyl)-5-[(E)-3-ethoxy-3-oxo-prop-1-enyl]pyrrol-2-yl]prop-2-enoate Ethyl (E)-3-[1-[2,6-bis(chloranyl)phenyl]carbonyl-5-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]pyrrol-2-yl]prop-2-enoate
Wiley ID 1383213