methanoic acid; 4-methyl-4-oxidanyl-pentan-2-one

Systemtic Name: methanoic acid; 4-methyl-4-oxidanyl-pentan-2-one Openeye Name: formic acid; 4-hydroxy-4-methyl-pentan-2-one CAS Name: formic acid; 4-hydroxy-4-methyl-2-pentanone IUPAC Name: formic acid; 4-hydroxy-4-methylpentan-2-one Traditional Name: formic acid; 4-hydroxy-4-methyl-pentan-2-one Formula: C7H14O4 MolecularWeight: 162.18366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C)O.C(=O)O

Isomeric SMILES

CC(=O)CC(C)(C)O.C(=O)O

InChI

InChI=1S/C6H12O2.CH2O2/c1-5(7)4-6(2,3)8;2-1-3/h8H,4H2,1-3H3;1H,(H,2,3)