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7,7-dimethyloctanoate; hexane

7,7-dimethyloctanoate; hexane

Systemtic Name:7,7-dimethyloctanoate; hexane
Openeye Name:7,7-dimethyloctanoate; hexane
CAS Name:7,7-dimethyloctanoate; hexane
IUPAC Name:7,7-dimethyloctanoate; hexane
Traditional Name:7,7-dimethylcaprylate; n-hexane
Formula: C16H33O2-
MolecularWeight: 257.43202
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.CC(C)(C)CCCCCC(=O)[O-]


Isomeric SMILES

CCCCCC.CC(C)(C)CCCCCC(=O)[O-]


InChI

InChI=1S/C10H20O2.C6H14/c1-10(2,3)8-6-4-5-7-9(11)12;1-3-5-6-4-2/h4-8H2,1-3H3,(H,11,12);3-6H2,1-2H3/p-1


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