Acetyl-alpha-cedrene

CAS	32388-55-9
Structure
Synonyms	1-Cedr-8-en-9-ylethanone
IUPAC Name	1-[(1R,2R,5S,7R)-2,6,6,8-Tetramethyl-9-tricyclo[5.3.1.01,5]undec-8-enyl]ethanone
Molecular Weight	246.4
Canonical SMILES	CC1CCC2C13CC(C2(C)C)C(=C(C3)C(=O)C)C
InChI	InChI=1S/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3/t10-,14+,15+,17+/m1/s1
InChI Key	YBUIAJZFOGJGLJ-SWRJLBSHSA-N
Boiling Point	272 °C
Flash Point	>230 °F
Purity	98%+
Density	0.997 g/mL at 25 °C(lit.)
Exact Mass	246.198365449
Isomeric SMILES	C[C@@H]1CC[C@@H]2[C@@]13C[C@H](C2(C)C)C(=C(C3)C(=O)C)C
Monoisotopic Mass	246.198365449
Physical State	Liquid
Refractive Index	n20/D 1.516(lit.)
Storage Conditions	Inert atmosphere,2-8 °C
Topological Polar Surface Area	17.1 Ų