1-adamantyloxy-bis(trideuteriomethyl)sulfanium; methanesulfonate

Systemtic Name: 1-adamantyloxy-bis(trideuteriomethyl)sulfanium; methanesulfonate Openeye Name: 1-adamantyloxy-bis(trideuteriomethyl)sulfonium; methanesulfonate CAS Name: 1-adamantyloxy-bis(trideuteriomethyl)sulfonium; methanesulfonate IUPAC Name: 1-adamantyloxy-bis(trideuteriomethyl)sulfanium; methanesulfonate Traditional Name: 1-adamantyloxy-bis(trideuteriomethyl)sulfonium mesylate Formula: C13H24O4S2 MolecularWeight: 314.494231

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](C)OC12CC3CC(C1)CC(C3)C2.CS(=O)(=O)[O-]

Isomeric SMILES

[2H]C([2H])([2H])[S+](C([2H])([2H])[2H])OC12CC3CC(C1)CC(C3)C2.CS(=O)(=O)[O-]

InChI

InChI=1S/C12H21OS.CH4O3S/c1-14(2)13-12-6-9-3-10(7-12)5-11(4-9)8-12;1-5(2,3)4/h9-11H,3-8H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1/i1D3,2D3;