CID 4397176

2-chloro-5-iodopyridine

Structural Information

Molecular Formula
C5H3ClIN
SMILES
C1=CC(=NC=C1I)Cl
InChI
InChI=1S/C5H3ClIN/c6-5-2-1-4(7)3-8-5/h1-3H
InChIKey
QWLGCWXSNYKKDO-UHFFFAOYSA-N
Compound name
2-chloro-5-iodopyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1668
Patents

238.89987 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.90715 125.3
[M+Na]+ 261.88909 132.9
[M+NH4]+ 256.93369 130.9
[M+K]+ 277.86303 129.0
[M-H]- 237.89259 121.7
[M+Na-2H]- 259.87454 121.9
[M]+ 238.89932 124.7
[M]- 238.90042 124.7
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