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5-Acetyl-4-(2-keto-1H-pyridin-3-yl)-1H-pyrrole-2-carboxylic acid methyl ester
SpectraBase Compound ID 9FXYnoArshz
InChI InChI=1S/C13H12N2O4/c1-7(16)11-9(6-10(15-11)13(18)19-2)8-4-3-5-14-12(8)17/h3-6,15H,1-2H3,(H,14,17)
InChIKey MMYNGFAOCQNRGW-UHFFFAOYSA-N
Mol Weight 260.25 g/mol
Molecular Formula C13H12N2O4
Exact Mass 260.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYO0dugkeGO
Name 5-Acetyl-4-(2-keto-1H-pyridin-3-yl)-1H-pyrrole-2-carboxylic acid methyl ester
Alternate Name(s) 5-Acetyl-4-(2-oxo-1H-pyridin-3-yl)-1H-pyrrole-2-carboxylic acid methyl ester Methyl 5-acetyl-4-(2-oxo-1H-pyridin-3-yl)-1H-pyrrole-2-carboxylate Methyl 5-ethanoyl-4-(2-oxidanylidene-1H-pyridin-3-yl)-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O4
InChI InChI=1S/C13H12N2O4/c1-7(16)11-9(6-10(15-11)13(18)19-2)8-4-3-5-14-12(8)17/h3-6,15H,1-2H3,(H,14,17)
InChIKey MMYNGFAOCQNRGW-UHFFFAOYSA-N
Molecular Weight 260.249 g/mol
SMILES [nH]1c(c(C=2C(NC=CC2)=O)cc1C(=O)OC)C(=O)C
SPLASH splash10-03di-2290000000-940fe720487e040c6806
Source of Spectrum E1-46-408-34
Wiley ID 1554221