CID 46318143

5-bromo-4-chloro-3-iodopyridin-2-amine

Structural Information

Molecular Formula
C5H3BrClIN2
SMILES
C1=C(C(=C(C(=N1)N)I)Cl)Br
InChI
InChI=1S/C5H3BrClIN2/c6-2-1-10-5(9)4(8)3(2)7/h1H,(H2,9,10)
InChIKey
VUZRKELWKYLVBZ-UHFFFAOYSA-N
Compound name
5-bromo-4-chloro-3-iodopyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

331.8213 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.82858 140.7
[M+Na]+ 354.81052 148.3
[M-H]- 330.81402 139.3
[M+NH4]+ 349.85512 157.4
[M+K]+ 370.78446 141.2
[M+H-H2O]+ 314.81856 137.5
[M+HCOO]- 376.81950 153.8
[M+CH3COO]- 390.83515 194.3
[M+Na-2H]- 352.79597 137.0
[M]+ 331.82075 156.0
[M]- 331.82185 156.0
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