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1H-Pyrrole-2,5-dicarboxylic acid, 3-methyl-, diethyl ester
SpectraBase Compound ID 5xDxgRHn4Jt
InChI InChI=1S/C11H15NO4/c1-4-15-10(13)8-6-7(3)9(12-8)11(14)16-5-2/h6,12H,4-5H2,1-3H3
InChIKey HIHHBIPXHZOHJJ-UHFFFAOYSA-N
Mol Weight 225.24 g/mol
Molecular Formula C11H15NO4
Exact Mass 225.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4um8BhYMUK4
Name 1H-Pyrrole-2,5-dicarboxylic acid, 3-methyl-, diethyl ester
Alternate Name(s) Diethyl 3-methyl-1H-pyrrole-2,5-dicarboxylate 3-Methyl-1H-pyrrole-2,5-dicarboxylic acid diethyl ester
CAS Registry Number 29170-87-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO4
InChI InChI=1S/C11H15NO4/c1-4-15-10(13)8-6-7(3)9(12-8)11(14)16-5-2/h6,12H,4-5H2,1-3H3
InChIKey HIHHBIPXHZOHJJ-UHFFFAOYSA-N
Molecular Weight 225.244 g/mol
SMILES [nH]1c(c(cc1C(=O)OCC)C)C(=O)OCC
SPLASH splash10-0faj-1910000000-c86f8698f7bd02efa616
Source of Spectrum W5-18983-0-0
Wiley ID 1226283