bisabolone oxide A
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IUPAC Name :(6S)-2,2,6-trimethyl-6-[(1S)-4-methylcyclohex-3-en-1-yl]oxan-3-one
InChI :InChI=1/C15H24O2/c1-11-5-7-12(8-6-11)15(4)10-9-13(16)14(2,3)17-15/h5,12H,6-10H2,1-4H3/t12-,15+/m1/s1
Std.InChI: InChI=1S/C15H24O2/c1-11-5-7-12(8-6-11)15(4)10-9-13(16)14(2,3)17-15/h5,12H,6-10H2,1-4H3/t12-,15+/m1/s1
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InChIKey :MJWZYBQLHJQQJJ-DOMZBBRYBL
Std.InChIKey: MJWZYBQLHJQQJJ-DOMZBBRYSA-N
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SMILES :CC1=CC[C@H](CC1)[C@@]2(CCC(=O)C(O2)(C)C)C
Molar Refractivity :68.75 ± 0.3 cm3 (est)
Parachor :571.7 ± 6.0 cm3 (est)
Index of Refraction :1.479 ± 0.02 (est)
Surface Tension :31.0 ± 3.0 dyne/cm (est)
Density :0.975 ± 0.06 g/cm3 (est)
Polarizability :27.25 ± 0.5 10-24cm3 (est)