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1H-Pyrrole-3-propanoic acid, 5,5'-methylenebis[2-(ethoxycarbonyl)-4-methyl-, dimethyl ester
SpectraBase Compound ID 7jXlvxUnRFz
InChI InChI=1S/C25H34N2O8/c1-7-34-24(30)22-16(9-11-20(28)32-5)14(3)18(26-22)13-19-15(4)17(10-12-21(29)33-6)23(27-19)25(31)35-8-2/h26-27H,7-13H2,1-6H3
InChIKey AKJYLULGFZLUNC-UHFFFAOYSA-N
Mol Weight 490.6 g/mol
Molecular Formula C25H34N2O8
Exact Mass 490.231516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NZydVpeRKp
Name 1H-Pyrrole-3-propanoic acid, 5,5'-methylenebis[2-(ethoxycarbonyl)-4-methyl-, dimethyl ester
CAS Registry Number 76003-88-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34N2O8
InChI InChI=1S/C25H34N2O8/c1-7-34-24(30)22-16(9-11-20(28)32-5)14(3)18(26-22)13-19-15(4)17(10-12-21(29)33-6)23(27-19)25(31)35-8-2/h26-27H,7-13H2,1-6H3
InChIKey AKJYLULGFZLUNC-UHFFFAOYSA-N
Molecular Weight 490.553 g/mol
SMILES [nH]1c(c(c(c1Cc1c(c(c([nH]1)C(=O)OCC)CCC(=O)OC)C)C)CCC(=O)OC)C(=O)OCC
SPLASH splash10-0f6x-0032900000-38563b5d89b154837866
Source of Spectrum F-36-1837-0
Synonyms 5,5'-di(ethoxycarbonyl)-4,4'-di(2''-methoxycarbonylethyl)-3,3'-dimethyl-2,2'-dipyrromethane 5,5'-Di(ethoxycarbonyl)-4,4'-di(2''-methoxycarbonylethyl)-3,3'-dimethyl-2,2'-dipyrromethane Ethyl 5-{[5-(ethoxycarbonyl)-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrol-2-yl]methyl}-3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrole-2-carboxylate
Wiley ID 1397208