ethanoic acid; 1-phenylpropan-2-one

Systemtic Name: ethanoic acid; 1-phenylpropan-2-one Openeye Name: acetic acid; 1-phenylpropan-2-one CAS Name: acetic acid; 1-phenyl-2-propanone IUPAC Name: acetic acid; 1-phenylpropan-2-one Traditional Name: acetic acid; 1-phenylacetone Formula: C11H14O3 MolecularWeight: 194.22706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10O.C2H4O2/c1-8(10)7-9-5-3-2-4-6-9;1-2(3)4/h2-6H,7H2,1H3;1H3,(H,3,4)