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[3-(4-chloro-benzoyl)-4-hydroxy-2-(3-nitro-phenyl)-5-oxo-2,5-dihydro-pyrrol-1-yl]-acetic acid
SpectraBase Compound ID L1Njfqxo611
InChI InChI=1S/C19H13ClN2O7/c20-12-6-4-10(5-7-12)17(25)15-16(11-2-1-3-13(8-11)22(28)29)21(9-14(23)24)19(27)18(15)26/h1-8,16,26H,9H2,(H,23,24)
InChIKey ZBYUHTUIQSPBPU-UHFFFAOYSA-N
Mol Weight 416.77 g/mol
Molecular Formula C19H13ClN2O7
Exact Mass 416.041128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HYhoGEt4Mu
Name [3-(4-chloro-benzoyl)-4-hydroxy-2-(3-nitro-phenyl)-5-oxo-2,5-dihydro-pyrrol-1-yl]-acetic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H13ClN2O7
InChI InChI=1S/C19H13ClN2O7/c20-12-6-4-10(5-7-12)17(25)15-16(11-2-1-3-13(8-11)22(28)29)21(9-14(23)24)19(27)18(15)26/h1-8,16,26H,9H2,(H,23,24)
InChIKey ZBYUHTUIQSPBPU-UHFFFAOYSA-N
Molecular Weight 416.773 g/mol
SMILES OC(CN1C(C(=C(C1=O)O)C(c1ccc(cc1)Cl)=O)c1cc(N(=O)=O)ccc1)=O
SPLASH splash10-000i-7900000000-903210d89869c6878163
Synonyms [3-(4-chlorobenzoyl)-4-hydroxy-2-(3-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]acetic acid
Wiley ID 1448179