CID 22121247

5-chloro-3,6-difluoropyridin-2-amine

Structural Information

Molecular Formula
C5H3ClF2N2
SMILES
C1=C(C(=NC(=C1Cl)F)N)F
InChI
InChI=1S/C5H3ClF2N2/c6-2-1-3(7)5(9)10-4(2)8/h1H,(H2,9,10)
InChIKey
ZJBWTBQUJBHTHS-UHFFFAOYSA-N
Compound name
5-chloro-3,6-difluoropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

93
Patents

163.99529 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.00257 124.3
[M+Na]+ 186.98451 136.3
[M-H]- 162.98801 124.4
[M+NH4]+ 182.02911 144.7
[M+K]+ 202.95845 132.0
[M+H-H2O]+ 146.99255 117.7
[M+HCOO]- 208.99349 142.6
[M+CH3COO]- 223.00914 178.7
[M+Na-2H]- 184.96996 130.2
[M]+ 163.99474 122.3
[M]- 163.99584 122.3
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

patents stripe