Molecular properties
- Formula
- C13H18O
- Molar mass
- 190.29 g·mol−1
- Exact mass
- 190.1358 Da
- 5
- PubChem CID
- 170813
Molecule record
4-hexylbenzaldehyde
C13H18O
190.29 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
- 4-N-HEXYLBENZALDEHYDE
- 49763-69-1
- A1-79609
- AKOS023873983
- BDBM85655
- Benzaldehyde, 4-hexyl-
- DB-051690
- DTXCID7040738
Show all 21 synonyms
- DTXSID5068522
- EINECS 256-479-3
- MFCD00041871
- NS00031965
- RefChem:561372
- SBB059138
- SCHEMBL1884477
- SCHEMBL2119883
- ST51044266
- p-Hexylbenzaldehyde
- p-Hexylbenzaldehyde, j
- p-n-hexylbenzaldehyde
- parahexylbenzaldehyde
Structure identifiers
- Canonical SMILES
- CCCCCCc1ccc(C=O)cc1
- Isomeric SMILES
- CCCCCCC1=CC=C(C=C1)C=O
- InChI
- InChI=1S/C13H18O/c1-2-3-4-5-6-12-7-9-13(11-14)10-8-12/h7-11H,2-6H2,1H3
- InChIKey
- KRNAJRBXIMJEFF-UHFFFAOYSA-N
- PubChem CID
- 170813
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-hexylbenzaldehyde; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-hexylbenzaldehyde; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.