theaspirane B
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IUPAC Name :(3S,5R)-3,7,10,10-tetramethyl-4-oxaspiro[4.5]dec-7-ene
InChI :InChI=1/C13H22O/c1-10-5-7-12(3,4)13(9-10)8-6-11(2)14-13/h5,11H,6-9H2,1-4H3/t11-,13+/m0/s1
Std.InChI: InChI=1S/C13H22O/c1-10-5-7-12(3,4)13(9-10)8-6-11(2)14-13/h5,11H,6-9H2,1-4H3/t11-,13+/m0/s1
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InChIKey :NNECKRLYNIBDPN-WCQYABFABZ
Std.InChIKey: NNECKRLYNIBDPN-WCQYABFASA-N
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SMILES :C[C@H]1CC[C@@]2(O1)CC(=CCC2(C)C)C
Molar Refractivity :59.56 ± 0.4 cm3 (est)
Parachor :486.4 ± 6.0 cm3 (est)
Index of Refraction :1.488 ± 0.03 (est)
Surface Tension :30.7 ± 5.0 dyne/cm (est)
Density :0.94 ± 0.1 g/cm3 (est)
Polarizability :23.61 ± 0.5 10-24cm3 (est)