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5-Formyl-3-methyl-1-phenacyl-pyrrole-2,4-dicarboxylic acid diethyl ester
SpectraBase Compound ID 9KHoQNhJBjC
InChI InChI=1S/C20H21NO6/c1-4-26-19(24)17-13(3)18(20(25)27-5-2)21(15(17)12-22)11-16(23)14-9-7-6-8-10-14/h6-10,12H,4-5,11H2,1-3H3
InChIKey ULDCIYIMBUHSJW-UHFFFAOYSA-N
Mol Weight 371.39 g/mol
Molecular Formula C20H21NO6
Exact Mass 371.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dobpwp3X4s7
Name 5-formyl-3-methyl-1-phenacyl-pyrrole-2,4-dicarboxylic acid diethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO6
InChI InChI=1S/C20H21NO6/c1-4-26-19(24)17-13(3)18(20(25)27-5-2)21(15(17)12-22)11-16(23)14-9-7-6-8-10-14/h6-10,12H,4-5,11H2,1-3H3
InChIKey ULDCIYIMBUHSJW-UHFFFAOYSA-N
Molecular Weight 371.389 g/mol
SMILES c1([n](c(c(c1C(=O)OCC)C)C(=O)OCC)CC(=O)c1ccccc1)C=O
SPLASH splash10-0a4i-0904000000-388f198656e9e134d371
Source of Spectrum U1-1999-858-0
Synonyms Diethyl 5-formyl-3-methyl-1-phenacyl-pyrrole-2,4-dicarboxylate Diethyl 5-methanoyl-3-methyl-1-phenacyl-pyrrole-2,4-dicarboxylate 5-formyl-3-methyl-1-phenacylpyrrole-2,4-dicarboxylic acid diethyl ester
Wiley ID 752715