Molecular properties
- Formula
- C13H19NO
- Molar mass
- 205.30 g·mol−1
- Exact mass
- 205.1467 Da
- 5
- PubChem CID
- 53930184
Molecule record
3-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
- SCHEMBL15964806
- SCHEMBL7462073
Structure identifiers
- Canonical SMILES
- CCCCCCc1cccc(C(N)=O)c1
- Isomeric SMILES
- CCCCCCC1=CC(=CC=C1)C(=O)N
- InChI
- InChI=1S/C13H19NO/c1-2-3-4-5-7-11-8-6-9-12(10-11)13(14)15/h6,8-10H,2-5,7H2,1H3,(H2,14,15)
- InChIKey
- QBLDENOVKAUPBE-UHFFFAOYSA-N
- PubChem CID
- 53930184
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 3-hexylbenzamide; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-hexylbenzamide; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.