tert-butyl 3-ethyl-5-methyl-hexanoate

Systemtic Name: tert-butyl 3-ethyl-5-methyl-hexanoate Openeye Name: tert-butyl 3-ethyl-5-methyl-hexanoate CAS Name: 3-ethyl-5-methylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethyl-5-methylhexanoate Traditional Name: 3-ethyl-5-methyl-hexanoic acid tert-butyl ester Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H26O2/c1-7-11(8-10(2)3)9-12(14)15-13(4,5)6/h10-11H,7-9H2,1-6H3