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1H-Pyrrole-1,3-dicarboxylic acid, 2-methyl-, 3-ethyl 1-methyl ester
SpectraBase Compound ID 31aRyd5E3np
InChI InChI=1S/C10H13NO4/c1-4-15-9(12)8-5-6-11(7(8)2)10(13)14-3/h5-6H,4H2,1-3H3
InChIKey AKLYEXBFTOUUJI-UHFFFAOYSA-N
Mol Weight 211.22 g/mol
Molecular Formula C10H13NO4
Exact Mass 211.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42b1lEQvsrA
Name 1H-Pyrrole-1,3-dicarboxylic acid, 2-methyl-, 3-ethyl 1-methyl ester
CAS Registry Number 33004-80-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO4
InChI InChI=1S/C10H13NO4/c1-4-15-9(12)8-5-6-11(7(8)2)10(13)14-3/h5-6H,4H2,1-3H3
InChIKey AKLYEXBFTOUUJI-UHFFFAOYSA-N
Molecular Weight 211.217 g/mol
SMILES c1(c([n](C(=O)OC)cc1)C)C(=O)OCC
SPLASH splash10-07w9-2920000000-5047df4e07fa5b840709
Source of Spectrum I-55-902-0
Synonyms Pyrrole-1,3-dicarboxylic acid, 2-methyl-, 3-ethyl methyl ester 3-Ethoxycarbonyl-1-methoxycarbonyl-2-methylpyrrole 3-Ethyl 1-methyl 2-methyl-1H-pyrrole-1,3-dicarboxylate
Wiley ID 1210260