CID 70700961

6-chloro-5-iodopyridin-2-amine

Structural Information

Molecular Formula
C5H4ClIN2
SMILES
C1=CC(=NC(=C1I)Cl)N
InChI
InChI=1S/C5H4ClIN2/c6-5-3(7)1-2-4(8)9-5/h1-2H,(H2,8,9)
InChIKey
LTQCXIAUNZHCCC-UHFFFAOYSA-N
Compound name
6-chloro-5-iodopyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

122
Patents

253.91077 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.91805 132.7
[M+Na]+ 276.89999 136.1
[M-H]- 252.90349 128.2
[M+NH4]+ 271.94459 148.5
[M+K]+ 292.87393 138.3
[M+H-H2O]+ 236.90803 124.0
[M+HCOO]- 298.90897 147.9
[M+CH3COO]- 312.92462 183.8
[M+Na-2H]- 274.88544 127.9
[M]+ 253.91022 130.1
[M]- 253.91132 130.1
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

patents stripe