Molecule record

4-phenylpteridine

C12H8N4

208.22 g/mol

Loading structure

Molecular properties

Formula
C12H8N4
Molar mass
208.22 g·mol−1
Exact mass
208.0749 Da
11
PubChem CID
21590713

Functional groups

Aromatic ring

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • SCHEMBL27997621

Structure identifiers

Canonical SMILES
c1ccc(-c2ncnc3nccnc23)cc1
Isomeric SMILES
C1=CC=C(C=C1)C2=NC=NC3=NC=CN=C23
InChI
InChI=1S/C12H8N4/c1-2-4-9(5-3-1)10-11-12(16-8-15-10)14-7-6-13-11/h1-8H
InChIKey
YECXQXNIICVYOE-UHFFFAOYSA-N
PubChem CID
21590713

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 4-phenylpteridine; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-phenylpteridine; not experimental data.

Sources

Molecule identity

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

Open source record