(2E)-3,7-dimethylocta-2,6-dienal; propan-2-one

Systemtic Name: (2E)-3,7-dimethylocta-2,6-dienal; propan-2-one Openeye Name: acetone; (2E)-3,7-dimethylocta-2,6-dienal CAS Name: (2E)-3,7-dimethylocta-2,6-dienal; 2-propanone IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienal; propan-2-one Traditional Name: acetone; (2E)-3,7-dimethylocta-2,6-dienal Formula: C13H22O2 MolecularWeight: 210.31258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC=O)C)C.CC(=O)C

Isomeric SMILES

CC(=CCC/C(=C/C=O)/C)C.CC(=O)C

InChI

InChI=1S/C10H16O.C3H6O/c1-9(2)5-4-6-10(3)7-8-11;1-3(2)4/h5,7-8H,4,6H2,1-3H3;1-2H3/b10-7+;