CID 12275778

6-fluoropyridine-2,3-diamine

Structural Information

Molecular Formula
C5H6FN3
SMILES
C1=CC(=NC(=C1N)N)F
InChI
InChI=1S/C5H6FN3/c6-4-2-1-3(7)5(8)9-4/h1-2H,7H2,(H2,8,9)
InChIKey
OCAHJYPQETZMIC-UHFFFAOYSA-N
Compound name
6-fluoropyridine-2,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

127.05457 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.061846 121.1
[M+Na]+ 150.043788 130.6
[M-H]- 126.047294 122.1
[M+NH4]+ 145.088393 141.3
[M+K]+ 166.017728 128.2
[M+H-H2O]+ 110.051830 114.1
[M+HCOO]- 172.052771 145.5
[M+CH3COO]- 186.068421 175.2
[M+Na-2H]- 148.029236 128.0
[M]+ 127.05402142 116.2
[M]- 127.05511858 116.2
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