phenyl 3,5,5-trimethylhexanoate

Systemtic Name: phenyl 3,5,5-trimethylhexanoate Openeye Name: phenyl 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoic acid phenyl ester IUPAC Name: phenyl 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoic acid phenyl ester Formula: C15H22O2 MolecularWeight: 234.33398

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC1=CC=CC=C1)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)OC1=CC=CC=C1)CC(C)(C)C

InChI

InChI=1S/C15H22O2/c1-12(11-15(2,3)4)10-14(16)17-13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3