beta-citraurinene

Right Click Jmol Molecule For More Options. Jmol is a free download found Here.
IUPAC Name :(1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E)-3,7,12,16-tetramethylheptadeca-1,3,5,7,9,11,13,15-octaenyl]cyclohex-3-en-1-ol
InChI :InChI=1/C30H42O/c1-23(2)13-11-16-24(3)14-9-10-15-25(4)17-12-18-26(5)19-20-29-27(6)21-28(31)22-30(29,7)8/h9-20,28,31H,21-22H2,1-8H3/b10-9+,16-11+,17-12+,20-19+,24-14+,25-15+,26-18+/t28-/m1/s1
Std.InChI: InChI=1S/C30H42O/c1-23(2)13-11-16-24(3)14-9-10-15-25(4)17-12-18-26(5)19-20-29-27(6)21-28(31)22-30(29,7)8/h9-20,28,31H,21-22H2,1-8H3/b10-9+,16-11+,17-12+,20-19+,24-14+,25-15+,26-18+/t28-/m1/s1
InChIKey :GKMHSJYLRXLVRG-QZMSTDJEBQ
Std.InChIKey: GKMHSJYLRXLVRG-QZMSTDJESA-N
SMILES :CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(C)C)/C)/C
Molar Refractivity :141.79 ± 0.3 cm3 (est)
Parachor :1079.7 ± 6.0 cm3 (est)
Index of Refraction :1.559 ± 0.02 (est)
Surface Tension :36.7 ± 3.0 dyne/cm (est)
Density :0.954 ± 0.06 g/cm3 (est)
Polarizability :56.21 ± 0.5 10-24cm3 (est)