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The IUPAC name of the compound is (2E,6Z)-nona-2,6-dienenitrile.
The molecular formula of the compound is C9H13N.
The molecular weight of the compound is 135.21 g/mol.
The CAS number of the compound is 97752-28-8.
The InChI of the compound is InChI=1S/C9H13N/c1-2-3-4-5-6-7-8-9-10/h3-4,7-8H,2,5-6H2,1H3/b4-3-,8-7+.
The InChIKey of the compound is DSOXXQLCMAEPEZ-ODYTWBPASA-N.
The canonical SMILES of the compound is CCC=CCCC=CC#N.
The isomeric SMILES of the compound is CC/C=C\CC/C=C/C#N.
The XLogP3-AA value of the compound is 2.5.
Yes, the compound is canonicalized.
97752-24-4
97752-25-5
97752-27-7
97752-29-9
97752-30-2
97752-31-3
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