methanesulfonate; (2,3,5,5-tetramethyl-4-oxidanylidene-hexan-2-yl)oxy-bis(trideuteriomethyl)sulfanium

Systemtic Name: methanesulfonate; (2,3,5,5-tetramethyl-4-oxidanylidene-hexan-2-yl)oxy-bis(trideuteriomethyl)sulfanium Openeye Name: methanesulfonate; (1,1,2,4,4-pentamethyl-3-oxo-pentoxy)-bis(trideuteriomethyl)sulfonium CAS Name: methanesulfonate; (2,3,5,5-tetramethyl-4-oxohexan-2-yl)oxy-bis(trideuteriomethyl)sulfonium IUPAC Name: methanesulfonate; (2,3,5,5-tetramethyl-4-oxohexan-2-yl)oxy-bis(trideuteriomethyl)sulfanium Traditional Name: (3-keto-1,1,2,4,4-pentamethyl-pentoxy)-bis(trideuteriomethyl)sulfonium mesylate Formula: C13H28O5S2 MolecularWeight: 334.525391

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C)(C)C)C(C)(C)O[S+](C)C.CS(=O)(=O)[O-]

Isomeric SMILES

[2H]C([2H])([2H])[S+](C([2H])([2H])[2H])OC(C)(C)C(C)C(=O)C(C)(C)C.CS(=O)(=O)[O-]

InChI

InChI=1S/C12H25O2S.CH4O3S/c1-9(10(13)11(2,3)4)12(5,6)14-15(7)8;1-5(2,3)4/h9H,1-8H3;1H3,(H,2,3,4)/q+1;/p-1/i7D3,8D3;