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4-(Benzylcarbamoyl)pyrrole-3-carboxylic Acid
SpectraBase Compound ID EohYhR5cm6h
InChI InChI=1S/C13H12N2O3/c16-12(10-7-14-8-11(10)13(17)18)15-6-9-4-2-1-3-5-9/h1-5,7-8,14H,6H2,(H,15,16)(H,17,18)
InChIKey YVAQSNUXZHBSAK-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C13H12N2O3
Exact Mass 244.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LqnaT04tE
Name 4-(Benzylcarbamoyl)pyrrole-3-carboxylic Acid
Alternate Name(s) 4-[(benzylamino)carbonyl]-1H-pyrrole-3-carboxylic acid
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Formula C13H12N2O3
InChI InChI=1S/C13H12N2O3/c16-12(10-7-14-8-11(10)13(17)18)15-6-9-4-2-1-3-5-9/h1-5,7-8,14H,6H2,(H,15,16)(H,17,18)
InChIKey YVAQSNUXZHBSAK-UHFFFAOYSA-N
Molecular Weight 244.250 g/mol
SMILES OC(c1c(c[nH]c1)C(NCc1ccccc1)=O)=O
SPLASH splash10-0a4u-7930000000-3ed5f0d2434ff7651a3b
Source of Spectrum B-44-323-0
Wiley ID 1246888