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4-(1H-pyrrole-3-carbonyl)nicotinic acid methyl ester

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4-(1H-pyrrole-3-carbonyl)nicotinic acid methyl ester
SpectraBase Compound ID KVux85CbGFS
InChI InChI=1S/C12H10N2O3/c1-17-12(16)10-7-14-5-3-9(10)11(15)8-2-4-13-6-8/h2-7,13H,1H3
InChIKey CWQHVHWAZFMIRY-UHFFFAOYSA-N
Mol Weight 230.22 g/mol
Molecular Formula C12H10N2O3
Exact Mass 230.069142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYDgjrclujF
Name Methyl 4-(1H-3-pyrroylcarbonyl)nicotinate
Alternate Name(s) 4-(1H-pyrrole-3-carbonyl)nicotinic acid methyl ester 4-[oxo(1H-pyrrol-3-yl)methyl]-3-pyridinecarboxylic acid methyl ester Methyl 4-(1H-pyrrole-3-carbonyl)pyridine-3-carboxylate Methyl 4-(1H-pyrrol-3-ylcarbonyl)pyridine-3-carboxylate
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Formula C12H10N2O3
InChI InChI=1S/C12H10N2O3/c1-17-12(16)10-7-14-5-3-9(10)11(15)8-2-4-13-6-8/h2-7,13H,1H3
InChIKey CWQHVHWAZFMIRY-UHFFFAOYSA-N
Molecular Weight 230.223 g/mol
SMILES [nH]1ccc(c1)C(c1c(C(=O)OC)cncc1)=O
SPLASH splash10-0006-9000000000-45970e001999e9946d28
Source of Spectrum H1-54-117-14
Wiley ID 1564266