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1H-Pyrrole-3-propanoic acid, 5,5'-methylenebis[2-formyl-4-(2-methoxy-2-oxoethyl)-, dimethyl ester
SpectraBase Compound ID H6Y5TezPpBg
InChI InChI=1S/C25H30N2O10/c1-34-22(30)7-5-14-16(9-24(32)36-3)18(26-20(14)12-28)11-19-17(10-25(33)37-4)15(21(13-29)27-19)6-8-23(31)35-2/h12-13,26-27H,5-11H2,1-4H3
InChIKey FSATXMSGKKATEL-UHFFFAOYSA-N
Mol Weight 518.52 g/mol
Molecular Formula C25H30N2O10
Exact Mass 518.190045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZwjMz4Tfnf
Name 1H-Pyrrole-3-propanoic acid, 5,5'-methylenebis[2-formyl-4-(2-methoxy-2-oxoethyl)-, dimethyl ester
Alternate Name(s) Methyl 3-[2-formyl-5-([5-formyl-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-2-yl]methyl)-4-(2-methoxy-2-oxoethyl)-1H-pyrrol-3-yl]propanoate 3-[2-formyl-5-[[5-formyl-3-(2-keto-2-methoxy-ethyl)-4-(3-keto-3-methoxy-propyl)-1H-pyrrol-2-yl]methyl]-4-(2-keto-2-methoxy-ethyl)-1H-pyrrol-3-yl]propionic acid methyl ester 3-[2-formyl-5-[[5-formyl-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-2-yl]methyl]-4-(2-methoxy-2-oxoethyl)-1H-pyrrol-3-yl]propanoic acid methyl ester methyl 3-[2-methanoyl-5-[[5-methanoyl-3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrol-2-yl]methyl]-4-(2-methoxy-2-oxidanylidene-ethyl)-1H-pyrrol-3-yl]propanoate methyl 3-[2-formyl-5-[[5-formyl-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-2-yl]methyl]-4-(2-methoxy-2-oxoethyl)-1H-pyrrol-3-yl]propanoate
CAS Registry Number 55258-98-5
Comments Removed - expert review: solvent contamination (chloroform)); A corrected record has been addded having SpectrumID: 1718225
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Formula C25H30N2O10
InChI InChI=1S/C25H30N2O10/c1-34-22(30)7-5-14-16(9-24(32)36-3)18(26-20(14)12-28)11-19-17(10-25(33)37-4)15(21(13-29)27-19)6-8-23(31)35-2/h12-13,26-27H,5-11H2,1-4H3
InChIKey FSATXMSGKKATEL-UHFFFAOYSA-N
Molecular Weight 518.519 g/mol
SMILES [nH]1c(c(c(c1Cc1c(c(c([nH]1)C=O)CCC(=O)OC)CC(=O)OC)CC(=O)OC)CCC(=O)OC)C=O
SPLASH splash10-001r-9000820000-4c223f355490d5defa79
Source of Spectrum KC-1976-287-0
Wiley ID 1401643