CID 167730149

6-bromo-5-fluoro-2-iodopyridin-3-amine

Structural Information

Molecular Formula
C5H3BrFIN2
SMILES
C1=C(C(=NC(=C1F)Br)I)N
InChI
InChI=1S/C5H3BrFIN2/c6-4-2(7)1-3(9)5(8)10-4/h1H,9H2
InChIKey
ILAPORLXRNOSLC-UHFFFAOYSA-N
Compound name
6-bromo-5-fluoro-2-iodopyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.85083 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.85811 140.4
[M+Na]+ 338.84005 147.1
[M-H]- 314.84355 138.0
[M+NH4]+ 333.88465 156.8
[M+K]+ 354.81399 141.5
[M+H-H2O]+ 298.84809 135.6
[M+HCOO]- 360.84903 156.7
[M+CH3COO]- 374.86468 193.4
[M+Na-2H]- 336.82550 136.3
[M]+ 315.85028 153.0
[M]- 315.85138 153.0
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

No patent data available for this compound.