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The molecular formula is C16H26O2.
The IUPAC name is [(E)-hex-3-enyl] (2E)-3,7-dimethylocta-2,6-dienoate.
The InChI is InChI=1S/C16H26O2/c1-5-6-7-8-12-18-16(17)13-15(4)11-9-10-14(2)3/h6-7,10,13H,5,8-9,11-12H2,1-4H3/b7-6+,15-13+.
The InChIKey is XQDXMUQTEGWQMP-BSIIKLCUSA-N.
The canonical SMILES is CCC=CCCOC(=O)C=C(C)CCC=C(C)C.
The isomeric SMILES is CC/C=C/CCOC(=O)/C=C(\C)/CCC=C(C)C.
The molecular weight is 250.38 g/mol.
The XLogP3-AA value is 5.2.
The compound has 0 hydrogen bond donor counts.
The compound has 9 rotatable bond counts.
96612-95-2
96-61-7
96618-91-6
96619-88-4
96619-89-5
96619-91-9
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