theaspirane B
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iupac名称 IUPAC Name :(3s (3S,5r）-3 5R)-3,7,10,10-四甲基-4-氧杂螺[4.5] dec-7-ene 10-tetramethyl-4-oxaspiro[4.5]dec-7-ene
INCHI InChI :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
印地 Std.InChI: 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
INCHI基 InChIKey :NNECKRLYNIBDPN-WCQYABFABZ
标准奇奇 Std.InChIKey: NNECKRLYNIBDPN-WCQYABFASA-N
微笑 SMILES :C[c @ h C@H]1cc CC[C@@]2(O1)cc CC(=cc CCC2(C)C)C
磨牙 Molar 折射率 Refractivity :59.56 ± 0.4 cm3 (估 est)
Parachor :486.4 ± 6.0 cm3 (估 est)
折射率 Index of Refraction :1.488 ± 0.03 (估 est)
表面张力 Surface Tension :30.7 ± 5.0 dyne/cm (估 est)
密度 Density :0.94 ± 0.1 g/cm3 (估 est)
极化率 Polarizability :23.61 ± 0.5 10-24cm3 (估 est)