CID 4245240

2,5-diiodopyridine

Structural Information

Molecular Formula
C5H3I2N
SMILES
C1=CC(=NC=C1I)I
InChI
InChI=1S/C5H3I2N/c6-4-1-2-5(7)8-3-4/h1-3H
InChIKey
YHWFCFIXXMXRBF-UHFFFAOYSA-N
Compound name
2,5-diiodopyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

170
Patents

330.83548 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.842756 129.4
[M+Na]+ 353.824698 124.0
[M-H]- 329.828204 120.1
[M+NH4]+ 348.869303 139.5
[M+K]+ 369.798638 134.2
[M+H-H2O]+ 313.832740 117.9
[M+HCOO]- 375.833681 141.7
[M+CH3COO]- 389.849331 194.3
[M+Na-2H]- 351.810146 120.1
[M]+ 330.83493142 124.4
[M]- 330.83602858 124.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe