CID 609492

4-iodopyridine

Structural Information

Molecular Formula
C5H4IN
SMILES
C1=CN=CC=C1I
InChI
InChI=1S/C5H4IN/c6-5-1-3-7-4-2-5/h1-4H
InChIKey
RTLUPHDWSUGAOS-UHFFFAOYSA-N
Compound name
4-iodopyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3295
Patents

204.93884 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.94612 121.1
[M+Na]+ 227.92806 122.8
[M-H]- 203.93156 116.6
[M+NH4]+ 222.97266 138.0
[M+K]+ 243.90200 127.5
[M+H-H2O]+ 187.93610 111.7
[M+HCOO]- 249.93704 140.3
[M+CH3COO]- 263.95269 174.3
[M+Na-2H]- 225.91351 119.1
[M]+ 204.93829 117.7
[M]- 204.93939 117.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.