phenyl 2,2-dimethylpentaneperoxoate

Systemtic Name: phenyl 2,2-dimethylpentaneperoxoate Openeye Name: phenyl 2,2-dimethylpentaneperoxoate CAS Name: 2,2-dimethylpentaneperoxoic acid phenyl ester IUPAC Name: phenyl 2,2-dimethylpentaneperoxoate Traditional Name: 2,2-dimethylperoxyvaleric acid phenyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C(=O)OOC1=CC=CC=C1

Isomeric SMILES

CCCC(C)(C)C(=O)OOC1=CC=CC=C1

InChI

InChI=1S/C13H18O3/c1-4-10-13(2,3)12(14)16-15-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3