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1H-Pyrrole-2,5-dicarboxylic acid, 3-(2-ethoxy-2-oxoethyl)-4-methyl-, 2-ethyl ester
SpectraBase Compound ID IIzBAt8c9fb
InChI InChI=1S/C13H17NO6/c1-4-19-9(15)6-8-7(3)10(12(16)17)14-11(8)13(18)20-5-2/h14H,4-6H2,1-3H3,(H,16,17)
InChIKey ACWVGUDMWXOPSR-UHFFFAOYSA-N
Mol Weight 283.28 g/mol
Molecular Formula C13H17NO6
Exact Mass 283.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AO0Va5sCHL4
Name 1H-Pyrrole-2,5-dicarboxylic acid, 3-(2-ethoxy-2-oxoethyl)-4-methyl-, 2-ethyl ester
CAS Registry Number 87377-67-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO6
InChI InChI=1S/C13H17NO6/c1-4-19-9(15)6-8-7(3)10(12(16)17)14-11(8)13(18)20-5-2/h14H,4-6H2,1-3H3,(H,16,17)
InChIKey ACWVGUDMWXOPSR-UHFFFAOYSA-N
Molecular Weight 283.280 g/mol
SMILES [nH]1c(C(=O)O)c(c(c1C(=O)OCC)CC(=O)OCC)C
SPLASH splash10-0bt9-0490000000-6050b43009b55619076b
Source of Spectrum F-39-1853-0
Synonyms 5-(ethoxycarbonyl)-4-(2-ethoxy-2-oxoethyl)-3-methyl-1H-pyrrole-2-carboxylic acid 5-Ethoxycarbonyl-4-(ethoxycarbonylmethyl)-3-methylpyrrole-2-carboxylic acid
Wiley ID 1286777