2-adamantyl hexanoate

Systemtic Name: 2-adamantyl hexanoate Openeye Name: 2-adamantyl hexanoate CAS Name: hexanoic acid 2-adamantyl ester IUPAC Name: 2-adamantyl hexanoate Traditional Name: hexanoic acid 2-adamantyl ester Formula: C16H26O2 MolecularWeight: 250.37644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1C2CC3CC(C2)CC1C3

Isomeric SMILES

CCCCCC(=O)OC1C2CC3CC(C2)CC1C3

InChI

InChI=1S/C16H26O2/c1-2-3-4-5-15(17)18-16-13-7-11-6-12(9-13)10-14(16)8-11/h11-14,16H,2-10H2,1H3