CAS Registry Number: 253870-02-9
Name:

5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid

2,4-dimethyl-5-formylpyrrole-3-carboxylic acid

Chemical Formula: C8H9NO3
Exact Mass: 167.06
Molecular Weight: 167.16
m/z: 167.06 (100.0%), 168.06 (9.2%)

InChI
InChI=1S/C8H9NO3/c1-4-6(3-10)9-5(2)7(4)8(11)12/h3,9H,1-2H3,(H,11,12)
InChI Key
YCIHQDVIAISDPS-UHFFFAOYSA-N
Canonical SMILES
CC1=C(NC(=C1C(=O)O)C)C=O

Specification

98%

ChemistrySelect (2018), 3(33), 9571-9575.

Journal of Chromatography B: Analytical Technologies in the Biomedical and Life Sciences (2018), 1092, 515-523.