Molecular properties
- Formula
- C16H26
- Molar mass
- 218.38 g·mol−1
- Exact mass
- 218.2035 Da
- 4
- PubChem CID
- 20740
Molecule record
decan-3-ylbenzene
C16H26
218.38 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (1-ETHYLOCTYL)BENZENE
- (3-Decyl)benzene
- 3-Phenyldecane
- 4621-36-7
- Benzene, (1-ethyloctyl)-
- Benzene,(1-ethyloctyl)-
- CHEBI:87601
- DTXCID601012995
Show all 19 synonyms
- DTXSID70874871
- Decane, 3-phenyl-
- NS00095865
- Q27159764
- RefChem:1068487
- SCHEMBL17183749
- SCHEMBL17183751
- SCHEMBL28188186
- SCHEMBL6162603
- SCHEMBL6682169
- SCHEMBL982809
Structure identifiers
- Canonical SMILES
- CCCCCCCC(CC)c1ccccc1
- Isomeric SMILES
- CCCCCCCC(CC)C1=CC=CC=C1
- InChI
- InChI=1S/C16H26/c1-3-5-6-7-9-12-15(4-2)16-13-10-8-11-14-16/h8,10-11,13-15H,3-7,9,12H2,1-2H3
- InChIKey
- PYVIFMPVFLOTLN-UHFFFAOYSA-N
- PubChem CID
- 20740
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 decan-3-ylbenzene; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for decan-3-ylbenzene; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.