Molecular properties
- Formula
- C22H38
- Molar mass
- 302.55 g·mol−1
- Exact mass
- 302.2973 Da
- 4
- PubChem CID
- 85613054
Molecule record
hexadecan-3-ylbenzene
C22H38
302.55 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
- 3-phenylhexadecane
- MKTSTLDMDBECRP-UHFFFAOYSA-N
- SCHEMBL28827761
Structure identifiers
- Canonical SMILES
- CCCCCCCCCCCCCC(CC)c1ccccc1
- Isomeric SMILES
- CCCCCCCCCCCCCC(CC)C1=CC=CC=C1
- InChI
- InChI=1S/C22H38/c1-3-5-6-7-8-9-10-11-12-13-15-18-21(4-2)22-19-16-14-17-20-22/h14,16-17,19-21H,3-13,15,18H2,1-2H3
- InChIKey
- MKTSTLDMDBECRP-UHFFFAOYSA-N
- PubChem CID
- 85613054
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 hexadecan-3-ylbenzene; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for hexadecan-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.