CID 44886970

2,6-dichloro-3,5-difluoro-4-aminopyridine

Structural Information

Molecular Formula
C5H2Cl2F2N2
SMILES
C1(=C(C(=NC(=C1F)Cl)Cl)F)N
InChI
InChI=1S/C5H2Cl2F2N2/c6-4-1(8)3(10)2(9)5(7)11-4/h(H2,10,11)
InChIKey
TWUISKGMAQMYBL-UHFFFAOYSA-N
Compound name
2,6-dichloro-3,5-difluoropyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.95631 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.96359 129.6
[M+Na]+ 220.94553 142.6
[M-H]- 196.94903 129.2
[M+NH4]+ 215.99013 149.2
[M+K]+ 236.91947 137.0
[M+H-H2O]+ 180.95357 123.9
[M+HCOO]- 242.95451 142.7
[M+CH3COO]- 256.97016 184.7
[M+Na-2H]- 218.93098 134.0
[M]+ 197.95576 129.0
[M]- 197.95686 129.0
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.