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5-Acetyl-4-(2-chloro-3-pyridinyl)-1H-pyrrole-2-carboxylic acid methyl ester
SpectraBase Compound ID LSCUaLehl6S
InChI InChI=1S/C13H11ClN2O3/c1-7(17)11-9(6-10(16-11)13(18)19-2)8-4-3-5-15-12(8)14/h3-6,16H,1-2H3
InChIKey LLYAQDGVBRHMQQ-UHFFFAOYSA-N
Mol Weight 278.69 g/mol
Molecular Formula C13H11ClN2O3
Exact Mass 278.04582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Jc3HzVltFy
Name 5-Acetyl-4-(2-chloro-3-pyridinyl)-1H-pyrrole-2-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11ClN2O3
InChI InChI=1S/C13H11ClN2O3/c1-7(17)11-9(6-10(16-11)13(18)19-2)8-4-3-5-15-12(8)14/h3-6,16H,1-2H3
InChIKey LLYAQDGVBRHMQQ-UHFFFAOYSA-N
Molecular Weight 278.695 g/mol
SMILES [nH]1c(c(cc1C(=O)OC)-c1c(nccc1)Cl)C(=O)C
SPLASH splash10-01ox-2090000000-00a4c92376f3e6a261c9
Source of Spectrum E1-46-408-9
Synonyms 5-Acetyl-4-(2-chloro-3-pyridyl)-1H-pyrrole-2-carboxylic acid methyl ester Methyl 4-(2-chloranylpyridin-3-yl)-5-ethanoyl-1H-pyrrole-2-carboxylate Methyl 5-acetyl-4-(2-chloro-3-pyridyl)-1H-pyrrole-2-carboxylate Methyl 5-acetyl-4-(2-chloropyridin-3-yl)-1H-pyrrole-2-carboxylate
Wiley ID 1554224