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

12
Patents

127.05457 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.06185 121.1
[M+Na]+ 150.04379 130.6
[M-H]- 126.04729 122.1
[M+NH4]+ 145.08839 141.3
[M+K]+ 166.01773 128.2
[M+H-H2O]+ 110.05183 114.1
[M+HCOO]- 172.05277 145.5
[M+CH3COO]- 186.06842 175.2
[M+Na-2H]- 148.02924 128.0
[M]+ 127.05402 116.2
[M]- 127.05512 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