methyl 2-ethanoyl-5-methyl-hexanoate

Systemtic Name: methyl 2-ethanoyl-5-methyl-hexanoate Openeye Name: methyl 2-acetyl-5-methyl-hexanoate CAS Name: 2-acetyl-5-methylhexanoic acid methyl ester IUPAC Name: methyl 2-acetyl-5-methylhexanoate Traditional Name: 2-acetyl-5-methyl-hexanoic acid methyl ester Formula: C10H18O3 MolecularWeight: 186.24812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(=O)C)C(=O)OC

Isomeric SMILES

CC(C)CCC(C(=O)C)C(=O)OC

InChI

InChI=1S/C10H18O3/c1-7(2)5-6-9(8(3)11)10(12)13-4/h7,9H,5-6H2,1-4H3