ethanoic acid; ethyl ethanoate; hexane; methanol

Systemtic Name: ethanoic acid; ethyl ethanoate; hexane; methanol Openeye Name: acetic acid; ethyl acetate; hexane; methanol CAS Name: acetic acid; acetic acid ethyl ester; hexane; methanol IUPAC Name: acetic acid; ethyl acetate; hexane; methanol Traditional Name: acetic acid; acetic acid ethyl ester; methanol; n-hexane Formula: C13H30O5 MolecularWeight: 266.3743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.CCOC(=O)C.CC(=O)O.CO

Isomeric SMILES

CCCCCC.CCOC(=O)C.CC(=O)O.CO

InChI

InChI=1S/C6H14.C4H8O2.C2H4O2.CH4O/c1-3-5-6-4-2;1-3-6-4(2)5;1-2(3)4;1-2/h3-6H2,1-2H3;3H2,1-2H3;1H3,(H,3,4);2H,1H3