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Molecule record

3-propan-2-ylquinoline

C12H13N

171.24 g/mol

Loading structure

Molecular properties

Formula
C12H13N
Molar mass
171.24 g·mol−1
Exact mass
171.1048 Da
7
PubChem CID
12494816

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-(1-Methylethyl)quinoline
  • 3-Isopropylquinoline
  • AKOS006371224
  • OZ4Y84N7A5
  • Quinoline, 3-(1-methylethyl)-
  • SCHEMBL1765966
  • SCHEMBL2607479
  • XLSPUCCTJJFXSW-UHFFFAOYSA-N

Structure identifiers

Canonical SMILES
CC(C)c1cnc2ccccc2c1
Isomeric SMILES
CC(C)C1=CC2=CC=CC=C2N=C1
InChI
InChI=1S/C12H13N/c1-9(2)11-7-10-5-3-4-6-12(10)13-8-11/h3-9H,1-2H3
InChIKey
XLSPUCCTJJFXSW-UHFFFAOYSA-N
PubChem CID
12494816

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 3-propan-2-ylquinoline; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-propan-2-ylquinoline; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record