Molecular properties
- Formula
- C13H19NO
- Molar mass
- 205.30 g·mol−1
- Exact mass
- 205.1467 Da
- 5
- PubChem CID
- 21388811
Molecule record
4-hexylbenzamide
C13H19NO
205.30 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Amide
Aromatic ring
Primary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- SCHEMBL10666525
- SCHEMBL351935
- SCHEMBL5544065
Structure identifiers
- Canonical SMILES
- CCCCCCc1ccc(C(N)=O)cc1
- Isomeric SMILES
- CCCCCCC1=CC=C(C=C1)C(=O)N
- InChI
- InChI=1S/C13H19NO/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-6H2,1H3,(H2,14,15)
- InChIKey
- WKQXYRWCTGMWCW-UHFFFAOYSA-N
- PubChem CID
- 21388811
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-hexylbenzamide; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-hexylbenzamide; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.