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acetic acid, [4-[3-(4-chlorobenzoyl)-2-(3-fluorophenyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]phenoxy]-
SpectraBase Compound ID 91jSVVlkT9Q
InChI InChI=1S/C25H17ClFNO6/c26-16-6-4-14(5-7-16)23(31)21-22(15-2-1-3-17(27)12-15)28(25(33)24(21)32)18-8-10-19(11-9-18)34-13-20(29)30/h1-12,22,32H,13H2,(H,29,30)
InChIKey PVNMTHZSBPPCFB-UHFFFAOYSA-N
Mol Weight 481.86 g/mol
Molecular Formula C25H17ClFNO6
Exact Mass 481.072843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74sandKe0mJ
Name [4-[3-(4-chloro-benzoyl)-2-(3-fluoro-phenyl)-4-hydroxy-5-oxo-2,5-dihydro-pyrrol-1-yl]-phenoxy]-acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H17ClFNO6
InChI InChI=1S/C25H17ClFNO6/c26-16-6-4-14(5-7-16)23(31)21-22(15-2-1-3-17(27)12-15)28(25(33)24(21)32)18-8-10-19(11-9-18)34-13-20(29)30/h1-12,22,32H,13H2,(H,29,30)
InChIKey PVNMTHZSBPPCFB-UHFFFAOYSA-N
Molecular Weight 481.863 g/mol
SMILES OC(COc1ccc(N2C(C(=C(C2c2cc(F)ccc2)C(c2ccc(cc2)Cl)=O)O)=O)cc1)=O
SPLASH splash10-000i-4920000000-3f6ff544ee0ba02b0ff4
Synonyms {4-[3-(4-chlorobenzoyl)-2-(3-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]phenoxy}acetic acid
Wiley ID 1466241