Molecular properties
- Formula
- C9H13N
- Molar mass
- 135.21 g·mol−1
- Exact mass
- 135.1048 Da
- 4
- PubChem CID
- 520879
Molecule record
3-tert-butylpyridine
C9H13N
135.21 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-t-butylpyridine
- 3-tert-butyl-pyridine
- 38031-78-6
- AKOS006342841
- DTXCID20285574
- DTXSID10334484
- InChI=1/C9H13N/c1-9(2,3)8-5-4-6-10-7-8/h4-7H,1-3H
- MFCD09965927
Show all 24 synonyms
- NBA03178
- Pyridine, 3-(1,1-dimethylethyl)-
- RefChem:95455
- SBB085905
- SCHEMBL177570
- SCHEMBL2249681
- SCHEMBL2249685
- SCHEMBL2250464
- SCHEMBL2251964
- SCHEMBL2251981
- SCHEMBL2254933
- SCHEMBL29583584
- SCHEMBL534299
- SCHEMBL74389
- SCHEMBL9204818
- pyridine, 3-t-butyl-
Structure identifiers
- Canonical SMILES
- CC(C)(C)c1cccnc1
- Isomeric SMILES
- CC(C)(C)C1=CN=CC=C1
- InChI
- InChI=1S/C9H13N/c1-9(2,3)8-5-4-6-10-7-8/h4-7H,1-3H3
- InChIKey
- FBUIIWHYTLCORM-UHFFFAOYSA-N
- PubChem CID
- 520879
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-tert-butylpyridine; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-tert-butylpyridine; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.