hexan-2-one; 5-methylhexan-2-one

Systemtic Name: hexan-2-one; 5-methylhexan-2-one Openeye Name: hexan-2-one; 5-methylhexan-2-one CAS Name: 2-hexanone; 5-methyl-2-hexanone IUPAC Name: hexan-2-one; 5-methylhexan-2-one Traditional Name: hexan-2-one; 5-methylhexan-2-one Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H14O.C6H12O/c1-6(2)4-5-7(3)8;1-3-4-5-6(2)7/h6H,4-5H2,1-3H3;3-5H2,1-2H3