CAS Registry Number: 116140-19-3

Name:

4-​Isoquinolinecarboxyl​ic acid, 1,​2,​3,​4-​tetrahydro-
1,​2,​3,​4-​Tetrahydro-​isoquinoline-​4-​carboxylic acid 

Chemical Formula: C10H11NO2
Exact Mass: 177.08
Molecular Weight: 177.20
m/z: 177.08 (100.0%), 178.08 (11.3%)

InChI: InChI=1S/C10H11NO2/c12-10(13)9-6-11-5-7-3-1-2-4-8(7)9/h1-4,9,11H,5-6H2,(H,12,13)
InChIKey: UZNKRPSOIPMUBF-UHFFFAOYSA-N
Canonical SMILES : C1C(C2=CC=CC=C2CN1)C(=O)O

Specification

98%

PCT Int. Appl. (2014), WO 2014078454 A1 20140522.                                  

PCT Int. Appl. (2013), WO 2013134226 A1 20130912.