columbaridione

Right Click Jmol Molecule For More Options. Jmol is a free download found Here.
InChI :InChI=1/C20H24O5/c1-9(2)12-15(21)13-10-8-11-19(3,4)6-5-7-20(11,18(24)25-10)14(13)17(23)16(12)22/h9-11,21H,5-8H2,1-4H3
Std.InChI: InChI=1S/C20H24O5/c1-9(2)12-15(21)13-10-8-11-19(3,4)6-5-7-20(11,18(24)25-10)14(13)17(23)16(12)22/h9-11,21H,5-8H2,1-4H3
InChIKey :PCMDDYKLZIZJHI-UHFFFAOYAJ
Std.InChIKey: PCMDDYKLZIZJHI-UHFFFAOYSA-N
SMILES :CC(C)C1=C(C2=C(C(=O)C1=O)C34CCCC(C3CC2OC4=O)(C)C)O
Molar Refractivity :88.96 ± 0.4 cm3 (est)
Parachor :712.8 ± 6.0 cm3 (est)
Index of Refraction :1.585 ± 0.03 (est)
Surface Tension :52.0 ± 5.0 dyne/cm (est)
Density :1.29 ± 0.1 g/cm3 (est)
Polarizability :35.26 ± 0.5 10-24cm3 (est)