hexyl 3-methylbutanoate

Systemtic Name: hexyl 3-methylbutanoate Openeye Name: hexyl 3-methylbutanoate CAS Name: 3-methylbutanoic acid hexyl ester IUPAC Name: hexyl 3-methylbutanoate Traditional Name: 3-methylbutyric acid hexyl ester Formula: C11H22O2 MolecularWeight: 186.29118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(C)C

Isomeric SMILES

CCCCCCOC(=O)CC(C)C

InChI

InChI=1S/C11H22O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h10H,4-9H2,1-3H3