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Pyrrole-2,5-dicarboxylic acid, 4-benzoyl-3-methyl-, 2-ethyl ester
SpectraBase Compound ID K6JBl4o4HT8
InChI InChI=1S/C16H15NO5/c1-3-22-16(21)12-9(2)11(13(17-12)15(19)20)14(18)10-7-5-4-6-8-10/h4-8,17H,3H2,1-2H3,(H,19,20)
InChIKey KQJMVPGKFYOQFF-UHFFFAOYSA-N
Mol Weight 301.3 g/mol
Molecular Formula C16H15NO5
Exact Mass 301.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKYjVeRdiwv
Name Pyrrole-2,5-dicarboxylic acid, 4-benzoyl-3-methyl-, 2-ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO5
InChI InChI=1S/C16H15NO5/c1-3-22-16(21)12-9(2)11(13(17-12)15(19)20)14(18)10-7-5-4-6-8-10/h4-8,17H,3H2,1-2H3,(H,19,20)
InChIKey KQJMVPGKFYOQFF-UHFFFAOYSA-N
Molecular Weight 301.298 g/mol
SMILES [nH]1c(c(c(c1C(=O)O)C(=O)c1ccccc1)C)C(=O)OCC
SPLASH splash10-0udi-6796000000-20d4d8c9e678d6d8c37a
Source of Spectrum AD-0-2532-0
Synonyms 3-Benzoyl-5-carbethoxy-4-methyl-1H-pyrrole-2-carboxylic acid 3-Benzoyl-5-ethoxycarbonyl-4-methyl-1H-pyrrole-2-carboxylic acid 5-Ethoxycarbonyl-4-methyl-3-(phenylcarbonyl)-1H-pyrrole-2-carboxylic acid
Wiley ID 1430041