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(E)-1-Benzyl-3-(4-chlorobenzylidene)-5-(4-methoxyphenyl)-1H-pyrrol-2(3H)-one
SpectraBase Compound ID 3A8II9Txva7
InChI InChI=1S/C25H20ClNO2/c1-29-23-13-9-20(10-14-23)24-16-21(15-18-7-11-22(26)12-8-18)25(28)27(24)17-19-5-3-2-4-6-19/h2-16H,17H2,1H3/b21-15+
InChIKey VSKNJPNXGOQHPT-RCCKNPSSSA-N
Mol Weight 401.89 g/mol
Molecular Formula C25H20ClNO2
Exact Mass 401.118257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gvqVWoXmrh
Name (E)-1-Benzyl-3-(4-chlorobenzylidene)-5-(4-methoxyphenyl)-1H-pyrrol-2(3H)-one
Alternate Name(s) (E)-1-benzyl-3-(4-chlorobenzylidene)-5-(4-methoxyphenyl)-1,3-dihydro-2H-pyrrol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20ClNO2
InChI InChI=1S/C25H20ClNO2/c1-29-23-13-9-20(10-14-23)24-16-21(15-18-7-11-22(26)12-8-18)25(28)27(24)17-19-5-3-2-4-6-19/h2-16H,17H2,1H3/b21-15+
InChIKey VSKNJPNXGOQHPT-RCCKNPSSSA-N
Literature Reference DOI 10.1016/j.bioorg.2016.03.007
Molecular Weight 401.893 g/mol
SMILES C1(N(C(=C\C1=C\c1ccc(cc1)Cl)c1ccc(cc1)OC)Cc1ccccc1)=O
SPLASH splash10-0udl-9252700000-33e05cefb70e61d7b626
Source of Spectrum Samar Hafez Abbas, et al. Bioorganic Chemistry, 10.1016/j.bioorg.2016.03.007
Wiley ID 1815992