6,6-dimethylhept-4-ynyl methanesulfonate

Systemtic Name: 6,6-dimethylhept-4-ynyl methanesulfonate Openeye Name: 6,6-dimethylhept-4-ynyl methanesulfonate CAS Name: methanesulfonic acid 6,6-dimethylhept-4-ynyl ester IUPAC Name: 6,6-dimethylhept-4-ynyl methanesulfonate Traditional Name: methanesulfonic acid 6,6-dimethylhept-4-ynyl ester Formula: C10H18O3S MolecularWeight: 218.31312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CCCCOS(=O)(=O)C

Isomeric SMILES

CC(C)(C)C#CCCCOS(=O)(=O)C

InChI

InChI=1S/C10H18O3S/c1-10(2,3)8-6-5-7-9-13-14(4,11)12/h5,7,9H2,1-4H3