CAS Registry Number: 38073-24-4
 Name:

3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole

1,3,4,5-Tetrahydro-6H-azepino[5,4,3-cd]indole

Chemical Formula: C11H12N2
Exact Mass: 172.10
Molecular Weight: 172.23
m/z: 172.10 (100.0%), 173.10 (12.6%)

InChI
InChI=1S/C11H12N2/c1-2-8-6-12-5-4-9-7-13-10(3-1)11(8)9/h1-3,7,12-13H,4-6H2
InChI Key
XJBGDSOYCGILCD-UHFFFAOYSA-N
Canonical SMILES
C1CNCC2=C3C1=CNC3=CC=C2

Specification

98%

Journal of Organic Chemistry, 80(1), 528-547; 2015