N,N-diethylethanamine; ethanenitrile; propan-2-one; hydrate

Systemtic Name: N,N-diethylethanamine; ethanenitrile; propan-2-one; hydrate Openeye Name: acetone; acetonitrile; N,N-diethylethanamine; hydrate CAS Name: acetonitrile; N,N-diethylethanamine; 2-propanone; hydrate IUPAC Name: acetonitrile; N,N-diethylethanamine; propan-2-one; hydrate Traditional Name: acetone; acetonitrile; triethylamine; hydrate Formula: C11H26N2O2 MolecularWeight: 218.33634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H15N.C3H6O.C2H3N.H2O/c1-4-7(5-2)6-3;1-3(2)4;1-2-3;/h4-6H2,1-3H3;1-2H3;1H3;1H2