5,5-dimethylcyclohexane-1,3-dione; phosphoric acid

Systemtic Name: 5,5-dimethylcyclohexane-1,3-dione; phosphoric acid Openeye Name: 5,5-dimethylcyclohexane-1,3-dione; phosphoric acid CAS Name: 5,5-dimethylcyclohexane-1,3-dione; phosphoric acid IUPAC Name: 5,5-dimethylcyclohexane-1,3-dione; phosphoric acid Traditional Name: 5,5-dimethylcyclohexane-1,3-quinone; phosphoric acid Formula: C8H15O6P MolecularWeight: 238.174861

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC(=O)C1)C.OP(=O)(O)O

Isomeric SMILES

CC1(CC(=O)CC(=O)C1)C.OP(=O)(O)O

InChI

InChI=1S/C8H12O2.H3O4P/c1-8(2)4-6(9)3-7(10)5-8;1-5(2,3)4/h3-5H2,1-2H3;(H3,1,2,3,4)