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4-[3-(4-fluoro-benzoyl)-2-(3-fluoro-phenyl)-4-hydroxy-5-oxo-2,5-dihydro-pyrrol-1-yl]-butyric acid
SpectraBase Compound ID 5gn31DkozO9
InChI InChI=1S/C21H17F2NO5/c22-14-8-6-12(7-9-14)19(27)17-18(13-3-1-4-15(23)11-13)24(21(29)20(17)28)10-2-5-16(25)26/h1,3-4,6-9,11,18,28H,2,5,10H2,(H,25,26)
InChIKey ANZQZOYNVBESFK-UHFFFAOYSA-N
Mol Weight 401.37 g/mol
Molecular Formula C21H17F2NO5
Exact Mass 401.107479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8t0TAx2C1On
Name 4-[3-(4-fluoro-benzoyl)-2-(3-fluoro-phenyl)-4-hydroxy-5-oxo-2,5-dihydro-pyrrol-1-yl]-butyric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17F2NO5
InChI InChI=1S/C21H17F2NO5/c22-14-8-6-12(7-9-14)19(27)17-18(13-3-1-4-15(23)11-13)24(21(29)20(17)28)10-2-5-16(25)26/h1,3-4,6-9,11,18,28H,2,5,10H2,(H,25,26)
InChIKey ANZQZOYNVBESFK-UHFFFAOYSA-N
Molecular Weight 401.366 g/mol
SMILES OC=1C(N(CCCC(O)=O)C(C1C(c1ccc(cc1)F)=O)c1cc(ccc1)F)=O
SPLASH splash10-00di-6930000000-b0259ac0d5a01b4ea83a
Synonyms 4-[3-(4-fluorobenzoyl)-2-(3-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid
Wiley ID 1443677