3,7,7-trimethyloctyl ethanoate

Systemtic Name: 3,7,7-trimethyloctyl ethanoate Openeye Name: 3,7,7-trimethyloctyl acetate CAS Name: acetic acid 3,7,7-trimethyloctyl ester IUPAC Name: 3,7,7-trimethyloctyl acetate Traditional Name: acetic acid 3,7,7-trimethyloctyl ester Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)C)CCOC(=O)C

Isomeric SMILES

CC(CCCC(C)(C)C)CCOC(=O)C

InChI

InChI=1S/C13H26O2/c1-11(8-10-15-12(2)14)7-6-9-13(3,4)5/h11H,6-10H2,1-5H3