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Molecule record

6-iodo-1H-indole

C8H6IN

243.05 g/mol

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Molecular properties

Formula
C8H6IN
Molar mass
243.05 g·mol−1
Exact mass
242.9545 Da
6
PubChem CID
10999215

Functional groups

Aromatic ring
Aryl halide

Physical properties

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

Common names and synonyms

  • 10.14272/UYFYWUXBZHYQRM-UHFFFAOYSA-N.1
  • 115666-47-2
  • 1H-Indole, 6-iodo-
  • 6-Iodoindole
  • AKOS016007678
  • CS-W022504
  • DA-36113
  • DS-2608
Show all 19 synonyms
  • DTXCID50402171
  • DTXSID60451352
  • F233292
  • MFCD09880048
  • RefChem:308626
  • SB30894
  • SCHEMBL30389969
  • SCHEMBL566682
  • SY099222
  • UYFYWUXBZHYQRM-UHFFFAOYSA-N
  • doi:10.14272/UYFYWUXBZHYQRM-UHFFFAOYSA-N.1

Structure identifiers

Canonical SMILES
Ic1ccc2cc[nH]c2c1
Isomeric SMILES
C1=CC(=CC2=C1C=CN2)I
InChI
InChI=1S/C8H6IN/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5,10H
InChIKey
UYFYWUXBZHYQRM-UHFFFAOYSA-N
PubChem CID
10999215

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 6-iodo-1H-indole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 6-iodo-1H-indole; 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