CID 165897817

3,6-difluoro-5-iodopyridin-2-amine

Structural Information

Molecular Formula
C5H3F2IN2
SMILES
C1=C(C(=NC(=C1I)F)N)F
InChI
InChI=1S/C5H3F2IN2/c6-2-1-3(8)4(7)10-5(2)9/h1H,(H2,9,10)
InChIKey
SSWXJMCZMHGTDB-UHFFFAOYSA-N
Compound name
3,6-difluoro-5-iodopyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.9309 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.93818 131.4
[M+Na]+ 278.92012 135.1
[M-H]- 254.92362 124.9
[M+NH4]+ 273.96472 146.5
[M+K]+ 294.89406 138.3
[M+H-H2O]+ 238.92816 120.4
[M+HCOO]- 300.92910 148.9
[M+CH3COO]- 314.94475 186.4
[M+Na-2H]- 276.90557 125.3
[M]+ 255.93035 125.3
[M]- 255.93145 125.3
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.