CAS Registry Number: 21598-06-1
Name:

5-hydroxy-1H-indole-2-carboxylic acid

5-Hydroxyindole-2-carboxylic acid

Chemical Formula: C9H7NO3
Exact Mass: 177.04
Molecular Weight: 177.16
m/z: 177.04 (100.0%), 178.05 (9.9%), 179.05 (1.1%)

InChI
InChI=1S/C9H7NO3/c11-6-1-2-7-5(3-6)4-8(10-7)9(12)13/h1-4,10-11H,(H,12,13)
InChI Key
BIMHWDJKNOMNLD-UHFFFAOYSA-N
Canonical SMILES
C1=CC2=C(C=C1O)C=C(N2)C(=O)O

Specification

98%

Analytical Methods (2015), 7(9), 3929-3938

Molecules (2010), 15, 7971-7984.