CID 28054476

3-bromo-5-iodopyridin-4-amine

Structural Information

Molecular Formula
C5H4BrIN2
SMILES
C1=C(C(=C(C=N1)I)N)Br
InChI
InChI=1S/C5H4BrIN2/c6-3-1-9-2-4(7)5(3)8/h1-2H,(H2,8,9)
InChIKey
OGUAUXDOIHVFPA-UHFFFAOYSA-N
Compound name
3-bromo-5-iodopyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

297.86026 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.867536 138.3
[M+Na]+ 320.849478 144.1
[M-H]- 296.852984 136.7
[M+NH4]+ 315.894083 155.1
[M+K]+ 336.823418 138.9
[M+H-H2O]+ 280.857520 134.2
[M+HCOO]- 342.858461 155.5
[M+CH3COO]- 356.874111 189.9
[M+Na-2H]- 318.834926 135.3
[M]+ 297.85971142 151.5
[M]- 297.86080858 151.5
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