Molecular properties
- Formula
- C11H14O
- Molar mass
- 162.23 g·mol−1
- Exact mass
- 162.1045 Da
- 5
- PubChem CID
- 22044178
Molecule record
4-butan-2-ylbenzaldehyde
C11H14O
162.23 g/mol
Loading structure
Functional groups
Aldehyde
Alkane / alkyl carbon
Aromatic ring
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 28293-43-8
- 4-(1-Methylpropyl)benzaldehyde
- 4-sec-Butylbenzaldehyde
- 856-979-7
- AKOS009331738
- Benzaldehyde, 4-(1-methylpropyl)-
- CS-0225913
- EN300-1252129
Show all 14 synonyms
- G50092
- IWOPTUDRCTVKBD-UHFFFAOYSA-N
- RefChem:515470
- SCHEMBL1532117
- SCHEMBL17103656
- Z385369904
Structure identifiers
- Canonical SMILES
- CCC(C)c1ccc(C=O)cc1
- Isomeric SMILES
- CCC(C)C1=CC=C(C=C1)C=O
- InChI
- InChI=1S/C11H14O/c1-3-9(2)11-6-4-10(8-12)5-7-11/h4-9H,3H2,1-2H3
- InChIKey
- IWOPTUDRCTVKBD-UHFFFAOYSA-N
- PubChem CID
- 22044178
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 4-butan-2-ylbenzaldehyde; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-butan-2-ylbenzaldehyde; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.