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4-[3-(4-fluoro-benzoyl)-4-hydroxy-2-(4-methoxy-phenyl)-5-oxo-2,5-dihydro-pyrrol-1-yl]-butyric acid
SpectraBase Compound ID JPGd5LbNzI0
InChI InChI=1S/C22H20FNO6/c1-30-16-10-6-13(7-11-16)19-18(20(27)14-4-8-15(23)9-5-14)21(28)22(29)24(19)12-2-3-17(25)26/h4-11,19,28H,2-3,12H2,1H3,(H,25,26)
InChIKey ZDYWSJJTIPXVIC-UHFFFAOYSA-N
Mol Weight 413.4 g/mol
Molecular Formula C22H20FNO6
Exact Mass 413.127466 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tl22g47ghh
Name 4-[3-(4-fluoro-benzoyl)-4-hydroxy-2-(4-methoxy-phenyl)-5-oxo-2,5-dihydro-pyrrol-1-yl]-butyric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20FNO6
InChI InChI=1S/C22H20FNO6/c1-30-16-10-6-13(7-11-16)19-18(20(27)14-4-8-15(23)9-5-14)21(28)22(29)24(19)12-2-3-17(25)26/h4-11,19,28H,2-3,12H2,1H3,(H,25,26)
InChIKey ZDYWSJJTIPXVIC-UHFFFAOYSA-N
Molecular Weight 413.401 g/mol
SMILES OC(CCCN1C(C(=C(C1=O)O)C(c1ccc(cc1)F)=O)c1ccc(OC)cc1)=O
SPLASH splash10-00di-5920000000-e7ddd147c19372c85162
Synonyms 4-[3-(4-fluorobenzoyl)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid
Wiley ID 1443684