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1H-Pyrrole-3-carboxylic acid, 5,5'-(1-hydroxy-2-oxo-1,2-ethanediyl)bis[2,4-dimethyl-, diethyl ester
SpectraBase Compound ID 8CPUb2Oe1a
InChI InChI=1S/C20H26N2O6/c1-7-27-19(25)13-9(3)15(21-11(13)5)17(23)18(24)16-10(4)14(12(6)22-16)20(26)28-8-2/h17,21-23H,7-8H2,1-6H3
InChIKey WYKJEXUSYWRICG-UHFFFAOYSA-N
Mol Weight 390.44 g/mol
Molecular Formula C20H26N2O6
Exact Mass 390.179087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdAL5FbfoWU
Name 1H-Pyrrole-3-carboxylic acid, 5,5'-(1-hydroxy-2-oxo-1,2-ethanediyl)bis[2,4-dimethyl-, diethyl ester
CAS Registry Number 120456-29-3
Comments Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 1364737 moved to the Legacy library
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O6
InChI InChI=1S/C20H26N2O6/c1-7-27-19(25)13-9(3)15(21-11(13)5)17(23)18(24)16-10(4)14(12(6)22-16)20(26)28-8-2/h17,21-23H,7-8H2,1-6H3
InChIKey WYKJEXUSYWRICG-UHFFFAOYSA-N
Molecular Weight 390.436 g/mol
SMILES [nH]1c(c(c(c1C(C(c1c(c(C(=O)OCC)c([nH]1)C)C)O)=O)C)C(=O)OCC)C
SPLASH splash10-01vp-0970000000-1cb054ce67732b9a0be9
Source of Spectrum AH-119-1035-8
Synonyms Ethyl 5-[[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl](hydroxy)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Ethyl-2,4-dimethyl-5-(2-hydroxy-2-(3,5-dimethyl-4-ethyloxycarbonyl-pyrrol-2-yl)-1-oxo-ethyl)-pyrrol-3-carboxylat
Wiley ID 1821265