4-oxidanylbutan-2-one; 1-phenylpropan-2-one

Systemtic Name: 4-oxidanylbutan-2-one; 1-phenylpropan-2-one Openeye Name: 4-hydroxybutan-2-one; 1-phenylpropan-2-one CAS Name: 4-hydroxy-2-butanone; 1-phenyl-2-propanone IUPAC Name: 4-hydroxybutan-2-one; 1-phenylpropan-2-one Traditional Name: 4-hydroxybutan-2-one; 1-phenylacetone Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10O.C4H8O2/c1-8(10)7-9-5-3-2-4-6-9;1-4(6)2-3-5/h2-6H,7H2,1H3;5H,2-3H2,1H3