Molecular properties
- Formula
- C11H14O
- Molar mass
- 162.23 g·mol−1
- Exact mass
- 162.1045 Da
- 5
- PubChem CID
- 12515981
Molecule record
2-butylbenzaldehyde
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
- 2-butyl-benzaldehyde
- 59059-42-6
- DTXCID20451853
- DTXSID60501043
- RefChem:258075
- SCHEMBL2119420
- SCHEMBL266417
- SCHEMBL27429990
Show all 9 synonyms
- butylbenzaldehyde
Structure identifiers
- Canonical SMILES
- CCCCc1ccccc1C=O
- Isomeric SMILES
- CCCCC1=CC=CC=C1C=O
- InChI
- InChI=1S/C11H14O/c1-2-3-6-10-7-4-5-8-11(10)9-12/h4-5,7-9H,2-3,6H2,1H3
- InChIKey
- IIBAAYFFTSJSFH-UHFFFAOYSA-N
- PubChem CID
- 12515981
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 2-butylbenzaldehyde; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-butylbenzaldehyde; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.