2-methylbutane; 3-methylheptane; thiophosphate

Systemtic Name: 2-methylbutane; 3-methylheptane; thiophosphate Openeye Name: 2-methylbutane; 3-methylheptane; thiophosphate CAS Name: 2-methylbutane; 3-methylheptane; thiophosphate IUPAC Name: 2-methylbutane; 3-methylheptane; thiophosphate Traditional Name: isopentane; 3-methylheptane; thiophosphate Formula: C13H30O3PS-3 MolecularWeight: 297.414261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC.CCC(C)C.[O-]P(=S)([O-])[O-]

Isomeric SMILES

CCCCC(C)CC.CCC(C)C.[O-]P(=S)([O-])[O-]

InChI

InChI=1S/C8H18.C5H12.H3O3PS/c1-4-6-7-8(3)5-2;1-4-5(2)3;1-4(2,3)5/h8H,4-7H2,1-3H3;5H,4H2,1-3H3;(H3,1,2,3,5)/p-3