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4-acetylpyrrole-2-carboxylic acid, methyl ester
SpectraBase Compound ID EAlkHaQwUFa
InChI InChI=1S/C8H9NO3/c1-5(10)6-3-7(9-4-6)8(11)12-2/h3-4,9H,1-2H3
InChIKey PHZUPQKYQRXDBE-UHFFFAOYSA-N
Mol Weight 167.16 g/mol
Molecular Formula C8H9NO3
Exact Mass 167.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1tbEiDAIaz5
Name Methyl 4-Acetyl-1H-pyrrole-2-carboxylate
Alternate Name(s) 4-Acetyl-1H-pyrrole-2-carboxylic acid methyl ester Methyl 4-ethanoyl-1H-pyrrole-2-carboxylate
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Formula C8H9NO3
InChI InChI=1S/C8H9NO3/c1-5(10)6-3-7(9-4-6)8(11)12-2/h3-4,9H,1-2H3
InChIKey PHZUPQKYQRXDBE-UHFFFAOYSA-N
Molecular Weight 167.164 g/mol
SMILES [nH]1cc(cc1C(=O)OC)C(=O)C
SPLASH splash10-00di-0900000000-9e25bc828b140cb8df14
Source of Spectrum E1-46-564-15
Wiley ID 1554276