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3-[3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
SpectraBase Compound ID 9CzSTR74ejn
InChI InChI=1S/C17H19NO7/c1-9(19)14-15(10-4-5-11(24-2)12(8-10)25-3)18(7-6-13(20)21)17(23)16(14)22/h4-5,8,15,22H,6-7H2,1-3H3,(H,20,21)
InChIKey YTDVGLMSBSDBCC-UHFFFAOYSA-N
Mol Weight 349.34 g/mol
Molecular Formula C17H19NO7
Exact Mass 349.116152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID y5XW4pFce
Name 3-[2-(3,4-dimethoxyphenyl)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]propanoic acid
Alternate Name(s) 3-[3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]propionic acid 3-[3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid 3-[3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]propanoic acid
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Formula C17H19NO7
InChI InChI=1S/C17H19NO7/c1-9(19)14-15(10-4-5-11(24-2)12(8-10)25-3)18(7-6-13(20)21)17(23)16(14)22/h4-5,8,15,22H,6-7H2,1-3H3,(H,20,21)
InChIKey YTDVGLMSBSDBCC-UHFFFAOYSA-N
Molecular Weight 349.339 g/mol
SMILES OC(CCN1C(C(=C(C1=O)O)C(=O)C)c1cc(OC)c(cc1)OC)=O
SPLASH splash10-0007-6963000000-14e8e43a12d411bb7e7f
Wiley ID 1453162