alpha-isomethyl ionone (90% min.)
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IUPAC Name :(E)-3-methyl-4-(2,6,6-trimethyl-1-cyclohex-2-enyl)but-3-en-2-one (90% min.)
InChI :InChI=1/C14H22O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h7,9,13H,6,8H2,1-5H3/b11-9+
Std.InChI: InChI=1S/C14H22O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h7,9,13H,6,8H2,1-5H3/b11-9+
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InChIKey :JRJBVWJSTHECJK-PKNBQFBNBZ
Std.InChIKey: JRJBVWJSTHECJK-PKNBQFBNSA-N
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SMILES :CC1=CCCC(C1/C=C(\C)/C(=O)C)(C)C
Molar Refractivity :66.18 ± 0.3 cm3 (est)
Parachor :528.4 ± 6.0 cm3 (est)
Index of Refraction :1.508 ± 0.02 (est)
Surface Tension :32.1 ± 3.0 dyne/cm (est)
Density :0.929 ± 0.06 g/cm3 (est)
Polarizability :26.23 ± 0.5 10-24cm3 (est)