CAS Registry Number: 10242-02-1
Name:

5-methyl-1H-indole-3-carboxylic acid

1H-Indole-3-carboxylic acid, 5-methyl-

Chemical Formula: C10H9NO2
Exact Mass: 175.06
Molecular Weight: 175.18
m/z: 175.06 (100.0%), 176.07 (11.0%)

InChI
InChI=1S/C10H9NO2/c1-6-2-3-9-7(4-6)8(5-11-9)10(12)13/h2-5,11H,1H3,(H,12,13)
InChI Key
TZNAHYKFVSHGDA-UHFFFAOYSA-N
Canonical SMILES
CC1=CC2=C(C=C1)NC=C2C(=O)O

Specification

98%

U.S. Pat. Appl. Publ. (2016), US 20160075684 A1 20160317

Heterocycles (2015), 90(2), 1196-1204.