CAS Registry Number:65875-05-0
Name:

5,6,7,7a,8,9,10,11-octahydro-4H-benzo[ef]heptalene

Chemical Formula: C15H20
Exact Mass: 200.16
Molecular Weight: 200.32
m/z: 200.16 (100.0%), 201.16 (16.5%), 202.16 (1.2%)

InChI
InChI=1S/C15H20/c1-3-8-13-10-5-11-14-9-4-2-7-12(6-1)15(13)14/h5,10-12H,1-4,6-9H2
InChI Key
ZQXLJPATXCLKDN-UHFFFAOYSA-N
Canonical SMILES
C1CCC2=C3C(C1)CCCCC3=CC=C2

Specification

98%

Bioorganic & Medicinal Chemistry (2013), 21(14), 4342-4350

PCT Int. Appl. (2009), WO 2009022721 A1 20090219.