(+)-nootkatone

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IUPAC Name :(4R,4aS,6R)-4,4a-dimethyl-6-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one
InChI :InChI=1/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3/t11-,12-,15+/m1/s1
Std.InChI: InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3/t11-,12-,15+/m1/s1
InChIKey :WTOYNNBCKUYIKC-JMSVASOKBQ
Std.InChIKey: WTOYNNBCKUYIKC-JMSVASOKSA-N
SMILES :C[C@@H]1CC(=O)C=C2[C@]1(C[C@@H](CC2)C(=C)C)C
MDL: MFCD00036591
Molar Refractivity :66.71 ± 0.4 cm3 (est)
Parachor :538.5 ± 6.0 cm3 (est)
Index of Refraction :1.503 ± 0.03 (est)
Surface Tension :32.5 ± 5.0 dyne/cm (est)
Density :0.96 ± 0.1 g/cm3 (est)
Polarizability :26.44 ± 0.5 10-24cm3 (est)