cyclohexanone; hexanoic acid

Systemtic Name: cyclohexanone; hexanoic acid Openeye Name: cyclohexanone; hexanoic acid CAS Name: cyclohexanone; hexanoic acid IUPAC Name: cyclohexanone; hexanoic acid Traditional Name: cyclohexanone; hexanoic acid Formula: C12H22O3 MolecularWeight: 214.30128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)O.C1CCC(=O)CC1

Isomeric SMILES

CCCCCC(=O)O.C1CCC(=O)CC1

InChI

InChI=1S/C6H12O2.C6H10O/c1-2-3-4-5-6(7)8;7-6-4-2-1-3-5-6/h2-5H2,1H3,(H,7,8);1-5H2