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acetic acid, [4-[3-benzoyl-2,5-dihydro-4-hydroxy-2-(3-nitrophenyl)-5-oxo-1H-pyrrol-1-yl]phenoxy]-
SpectraBase Compound ID 4zNyojYVJnj
InChI InChI=1S/C25H18N2O8/c28-20(29)14-35-19-11-9-17(10-12-19)26-22(16-7-4-8-18(13-16)27(33)34)21(24(31)25(26)32)23(30)15-5-2-1-3-6-15/h1-13,22,31H,14H2,(H,28,29)
InChIKey APXCVKRTGDEGAU-UHFFFAOYSA-N
Mol Weight 474.43 g/mol
Molecular Formula C25H18N2O8
Exact Mass 474.106316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YgPXAKhuJH
Name [4-[3-benzoyl-4-hydroxy-2-(3-nitro-phenyl)-5-oxo-2,5-dihydro-pyrrol-1-yl]-phenoxy]-acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H18N2O8
InChI InChI=1S/C25H18N2O8/c28-20(29)14-35-19-11-9-17(10-12-19)26-22(16-7-4-8-18(13-16)27(33)34)21(24(31)25(26)32)23(30)15-5-2-1-3-6-15/h1-13,22,31H,14H2,(H,28,29)
InChIKey APXCVKRTGDEGAU-UHFFFAOYSA-N
Molecular Weight 474.425 g/mol
SMILES OC(COc1ccc(N2C(C(=C(C2c2cc(N(=O)=O)ccc2)C(=O)c2ccccc2)O)=O)cc1)=O
SPLASH splash10-0a4i-8910000000-6b4eed662898fe3b51bd
Synonyms {4-[3-benzoyl-4-hydroxy-2-(3-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]phenoxy}acetic acid
Wiley ID 1453230