3,3-dimethyl-2-oxidanylidene-butanal hydrate

Systemtic Name: 3,3-dimethyl-2-oxidanylidene-butanal hydrate Openeye Name: 3,3-dimethyl-2-oxo-butanal hydrate CAS Name: 3,3-dimethyl-2-oxobutanal hydrate IUPAC Name: 3,3-dimethyl-2-oxobutanal hydrate Traditional Name: 2-keto-3,3-dimethyl-butyraldehyde hydrate Formula: C6H12O3 MolecularWeight: 132.15768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H10O2.H2O/c1-6(2,3)5(8)4-7;/h4H,1-3H3;1H2