3-methyltridecan-1-ol sulfate

Systemtic Name: 3-methyltridecan-1-ol sulfate Openeye Name: 3-methyltridecan-1-ol sulfate CAS Name: 3-methyl-1-tridecanol sulfate IUPAC Name: 3-methyltridecan-1-ol sulfate Traditional Name: 3-methyltridecan-1-ol sulfate Formula: C14H30O5S-2 MolecularWeight: 310.45

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)CCO.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCC(C)CCO.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C14H30O.H2O4S/c1-3-4-5-6-7-8-9-10-11-14(2)12-13-15;1-5(2,3)4/h14-15H,3-13H2,1-2H3;(H2,1,2,3,4)/p-2