CAS Registry Number: 65875-07-2
Name:

1-(5,6,7,7a,8,9,10,11-octahydro-4H-benzo[ef]heptalen-2-yl)ethanone

Chemical Formula: C17H22O
Exact Mass: 242.17
Molecular Weight: 242.36
m/z: 242.17 (100.0%), 243.17 (18.7%), 244.17 (1.8%)

InChI
InChI=1S/C17H22O/c1-12(18)16-10-14-8-4-2-6-13-7-3-5-9-15(11-16)17(13)14/h10-11,13H,2-9H2,1H3
InChI Key
QIPXCFRQLDJRKH-UHFFFAOYSA-N
Canonical SMILES
CC(=O)C1=CC2=C3C(CCCCC3=C1)CCCC2

Specification

98%

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

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