magnesium; hex-1-yne; phenylmethanolate; bromide

Systemtic Name: magnesium; hex-1-yne; phenylmethanolate; bromide Openeye Name: magnesium; hex-1-yne; phenylmethanolate; bromide CAS Name: magnesium; 1-hexyne; phenylmethanolate; bromide IUPAC Name: magnesium; hex-1-yne; phenylmethanolate; bromide Traditional Name: magnesium; hex-1-yne; phenylmethanolate; bromide Formula: C13H16BrMgO- MolecularWeight: 292.47454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#[C-].C1=CC=C(C=C1)C[O-].[Mg+2].[Br-]

Isomeric SMILES

CCCCC#[C-].C1=CC=C(C=C1)C[O-].[Mg+2].[Br-]

InChI

InChI=1S/C7H7O.C6H9.BrH.Mg/c8-6-7-4-2-1-3-5-7;1-3-5-6-4-2;;/h1-5H,6H2;3,5-6H2,1H3;1H;/q2*-1;;+2/p-1