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acetic acid, [4-[3-acetyl-2-(2,4-dichlorophenyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]phenoxy]-
SpectraBase Compound ID 47xuQ6RmYoM
InChI InChI=1S/C20H15Cl2NO6/c1-10(24)17-18(14-7-2-11(21)8-15(14)22)23(20(28)19(17)27)12-3-5-13(6-4-12)29-9-16(25)26/h2-8,18,27H,9H2,1H3,(H,25,26)
InChIKey BKGMWZQAVANGDC-UHFFFAOYSA-N
Mol Weight 436.25 g/mol
Molecular Formula C20H15Cl2NO6
Exact Mass 435.027643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96b6CqOUa2e
Name 2-[4-[2-(2,4-dichlorophenyl)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]phenoxy]ethanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15Cl2NO6
InChI InChI=1S/C20H15Cl2NO6/c1-10(24)17-18(14-7-2-11(21)8-15(14)22)23(20(28)19(17)27)12-3-5-13(6-4-12)29-9-16(25)26/h2-8,18,27H,9H2,1H3,(H,25,26)
InChIKey BKGMWZQAVANGDC-UHFFFAOYSA-N
Molecular Weight 436.247 g/mol
SMILES OC(COc1ccc(N2C(C(=C(C2c2c(cc(cc2)Cl)Cl)C(=O)C)O)=O)cc1)=O
SPLASH splash10-052f-4940100000-9756c331962c0de4d62e
Synonyms 2-[4-[3-acetyl-2-(2,4-dichlorophenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]phenoxy]acetic acid 2-[4-[3-acetyl-2-(2,4-dichlorophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]phenoxy]acetic acid {4-[3-acetyl-2-(2,4-dichlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]phenoxy}acetic acid
Wiley ID 1453403