methyl beta-ionyl acetate
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IUPAC Name :[(E,3S)-1-(2,6,6-trimethylcyclohexen-1-yl)pent-1-en-3-yl] acetate
InChI :InChI=1/C16H26O2/c1-6-14(18-13(3)17)9-10-15-12(2)8-7-11-16(15,4)5/h9-10,14H,6-8,11H2,1-5H3/b10-9+/t14-/m0/s1
Std.InChI: InChI=1S/C16H26O2/c1-6-14(18-13(3)17)9-10-15-12(2)8-7-11-16(15,4)5/h9-10,14H,6-8,11H2,1-5H3/b10-9+/t14-/m0/s1
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InChIKey :ZFLGHRQDYOPHNY-HBWSCVEGBC
Std.InChIKey: ZFLGHRQDYOPHNY-HBWSCVEGSA-N
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SMILES :CC[C@@H](/C=C/C1=C(CCCC1(C)C)C)OC(=O)C
Molar Refractivity :77.30 ± 0.3 cm3 (est)
Parachor :628.8 ± 6.0 cm3 (est)
Index of Refraction :1.506 ± 0.02 (est)
Surface Tension :34.2 ± 3.0 dyne/cm (est)
Density :0.963 ± 0.06 g/cm3 (est)
Polarizability :30.64 ± 0.5 10-24cm3 (est)