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3-[3-(4-chloro-benzoyl)-2-(2-chloro-phenyl)-4-hydroxy-5-oxo-2,5-dihydro-pyrrol-1-yl]-propionic acid
SpectraBase Compound ID DL5ScTa1ocY
InChI InChI=1S/C20H15Cl2NO5/c21-12-7-5-11(6-8-12)18(26)16-17(13-3-1-2-4-14(13)22)23(10-9-15(24)25)20(28)19(16)27/h1-8,17,27H,9-10H2,(H,24,25)
InChIKey MMECPSKSAARMQF-UHFFFAOYSA-N
Mol Weight 420.25 g/mol
Molecular Formula C20H15Cl2NO5
Exact Mass 419.032728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HvR5BocsXb
Name 3-[3-(4-chloro-benzoyl)-2-(2-chloro-phenyl)-4-hydroxy-5-oxo-2,5-dihydro-pyrrol-1-yl]-propionic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15Cl2NO5
InChI InChI=1S/C20H15Cl2NO5/c21-12-7-5-11(6-8-12)18(26)16-17(13-3-1-2-4-14(13)22)23(10-9-15(24)25)20(28)19(16)27/h1-8,17,27H,9-10H2,(H,24,25)
InChIKey MMECPSKSAARMQF-UHFFFAOYSA-N
Molecular Weight 420.248 g/mol
SMILES OC(CCN1C(C(=C(C1=O)O)C(c1ccc(cc1)Cl)=O)c1c(Cl)cccc1)=O
SPLASH splash10-01pc-4921000000-61d87326bb150e4b2095
Synonyms 3-[3-(4-chlorobenzoyl)-2-(2-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Wiley ID 1459510