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ethanoic acid; 2-methylpentane; hydrate

ethanoic acid; 2-methylpentane; hydrate

Systemtic Name:ethanoic acid; 2-methylpentane; hydrate
Openeye Name:acetic acid; 2-methylpentane; hydrate
CAS Name:acetic acid; 2-methylpentane; hydrate
IUPAC Name:acetic acid; 2-methylpentane; hydrate
Traditional Name:acetic acid; isohexane; hydrate
Formula: C14H34O3
MolecularWeight: 250.41796
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C.CCCC(C)C.CC(=O)O.O


Isomeric SMILES

CCCC(C)C.CCCC(C)C.CC(=O)O.O


InChI

InChI=1S/2C6H14.C2H4O2.H2O/c2*1-4-5-6(2)3;1-2(3)4;/h2*6H,4-5H2,1-3H3;1H3,(H,3,4);1H2


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