3,6-dimethylhept-1-yn-3-ol; 3-methylhex-4-yn-3-ol

Systemtic Name: 3,6-dimethylhept-1-yn-3-ol; 3-methylhex-4-yn-3-ol Openeye Name: 3,6-dimethylhept-1-yn-3-ol; 3-methylhex-4-yn-3-ol CAS Name: 3,6-dimethyl-1-heptyn-3-ol; 3-methyl-4-hexyn-3-ol IUPAC Name: 3,6-dimethylhept-1-yn-3-ol; 3-methylhex-4-yn-3-ol Traditional Name: 3,6-dimethylhept-1-yn-3-ol; 3-methylhex-4-yn-3-ol Formula: C16H28O2 MolecularWeight: 252.39232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#CC)O.CC(C)CCC(C)(C#C)O

Isomeric SMILES

CCC(C)(C#CC)O.CC(C)CCC(C)(C#C)O

InChI

InChI=1S/C9H16O.C7H12O/c1-5-9(4,10)7-6-8(2)3;1-4-6-7(3,8)5-2/h1,8,10H,6-7H2,2-4H3;8H,5H2,1-3H3