Molecular properties
- Formula
- C12H16O
- Molar mass
- 176.26 g·mol−1
- Exact mass
- 176.1201 Da
- 5
- PubChem CID
- 93214
Molecule record
1-[4-(2-methylpropyl)phenyl]ethanone
C12H16O
176.26 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Ketone
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1-(4-Isobutylphenyl)ethan-1-one
- 1-(4-Isobutylphenyl)ethanone
- 1-ACETYL-4-ISOBUTYLBENZENE
- 1-[4-(2-methylpropyl)phenyl]ethan-1-one
- 1-acetyl-4-(2-methylpropyl)benzene
- 254-159-8
- 38861-78-8
- 4'-(2-Methylpropyl)acetophenone
Show all 24 synonyms
- 4'-Isobutylacetophenone
- 4-lsobutylacetophenone
- 4a(2)-Isobutylacetophenone
- AML715RD20
- Acetophenone, 4-isobutyl-
- DTXCID9039571
- DTXSID6068147
- EINECS 254-159-8
- Ethanone, 1-[4-(2-methylpropyl)phenyl]-
- Ibuprofen EP Impurity E
- MFCD00027393
- NSC-173015
- RefChem:506156
- UNII-AML715RD20
- p-Isobutylacetophenone
- p-iso-Butylacetophenone
Structure identifiers
- Canonical SMILES
- CC(=O)c1ccc(CC(C)C)cc1
- Isomeric SMILES
- CC(C)CC1=CC=C(C=C1)C(=O)C
- InChI
- InChI=1S/C12H16O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13/h4-7,9H,8H2,1-3H3
- InChIKey
- KEAGRYYGYWZVPC-UHFFFAOYSA-N
- PubChem CID
- 93214
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 1-[4-(2-methylpropyl)phenyl]ethanone; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1-[4-(2-methylpropyl)phenyl]ethanone; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.