butan-2-one; 2-methyl-2-oxidanyl-1-phenyl-propan-1-one

Systemtic Name: butan-2-one; 2-methyl-2-oxidanyl-1-phenyl-propan-1-one Openeye Name: butan-2-one; 2-hydroxy-2-methyl-1-phenyl-propan-1-one CAS Name: 2-butanone; 2-hydroxy-2-methyl-1-phenyl-1-propanone IUPAC Name: butan-2-one; 2-hydroxy-2-methyl-1-phenylpropan-1-one Traditional Name: butan-2-one; 2-hydroxy-2-methyl-1-phenyl-propan-1-one Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C.CC(C)(C(=O)C1=CC=CC=C1)O

Isomeric SMILES

CCC(=O)C.CC(C)(C(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C10H12O2.C4H8O/c1-10(2,12)9(11)8-6-4-3-5-7-8;1-3-4(2)5/h3-7,12H,1-2H3;3H2,1-2H3