3-methylbutan-2-yl 3-ethylhexanoate

Systemtic Name: 3-methylbutan-2-yl 3-ethylhexanoate Openeye Name: 1,2-dimethylpropyl 3-ethylhexanoate CAS Name: 3-ethylhexanoic acid 3-methylbutan-2-yl ester IUPAC Name: 3-methylbutan-2-yl 3-ethylhexanoate Traditional Name: 3-ethylhexanoic acid 1,2-dimethylpropyl ester Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)CC(=O)OC(C)C(C)C

Isomeric SMILES

CCCC(CC)CC(=O)OC(C)C(C)C

InChI

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