ethanenitrile; 2-methylpropan-2-ol; hydrate

Systemtic Name: ethanenitrile; 2-methylpropan-2-ol; hydrate Openeye Name: acetonitrile; 2-methylpropan-2-ol; hydrate CAS Name: acetonitrile; 2-methyl-2-propanol; hydrate IUPAC Name: acetonitrile; 2-methylpropan-2-ol; hydrate Traditional Name: acetonitrile; 2-methylpropan-2-ol; hydrate Formula: C6H15NO2 MolecularWeight: 133.1888

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC(C)(C)O.O

Isomeric SMILES

CC#N.CC(C)(C)O.O

InChI

InChI=1S/C4H10O.C2H3N.H2O/c1-4(2,3)5;1-2-3;/h5H,1-3H3;1H3;1H2