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2-[2,4-dihydroxy-1-(4-methylphenyl)-5-oxo-2-phenyl-3-pyrrolyl]-2-oxoacetic acid propan-2-yl ester
SpectraBase Compound ID 312CmiUR5Cw
InChI InChI=1S/C22H21NO6/c1-13(2)29-21(27)19(25)17-18(24)20(26)23(16-11-9-14(3)10-12-16)22(17,28)15-7-5-4-6-8-15/h4-13,24,28H,1-3H3
InChIKey IEMSMVUSBMWOEN-UHFFFAOYSA-N
Mol Weight 395.41 g/mol
Molecular Formula C22H21NO6
Exact Mass 395.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54yv83SjiJu
Name 2-[2,4-dihydroxy-1-(4-methylphenyl)-5-oxo-2-phenyl-3-pyrrolyl]-2-oxoacetic acid propan-2-yl ester
Alternate Name(s) 2-[2,4-dihydroxy-5-keto-2-phenyl-1-(p-tolyl)-3-pyrrolin-3-yl]-2-keto-acetic acid isopropyl ester isopropyl 2-[2,4-dihydroxy-5-oxo-2-phenyl-1-(p-tolyl)pyrrol-3-yl]-2-oxo-acetate Propan-2-yl 2-[1-(4-methylphenyl)-2,4-bis(oxidanyl)-5-oxidanylidene-2-phenyl-pyrrol-3-yl]-2-oxidanylidene-ethanoate Propan-2-yl 2-[2,4-dihydroxy-1-(4-methylphenyl)-5-oxo-2-phenylpyrrol-3-yl]-2-oxoacetate
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Formula C22H21NO6
InChI InChI=1S/C22H21NO6/c1-13(2)29-21(27)19(25)17-18(24)20(26)23(16-11-9-14(3)10-12-16)22(17,28)15-7-5-4-6-8-15/h4-13,24,28H,1-3H3
InChIKey IEMSMVUSBMWOEN-UHFFFAOYSA-N
Molecular Weight 395.411 g/mol
SMILES OC=1C(N(C(C1C(C(OC(C)C)=O)=O)(c1ccccc1)O)c1ccc(cc1)C)=O
SPLASH splash10-0a4i-8924000000-07bde0caed42cde38c15
Wiley ID 1447047