CID 819440

5-amino-2-fluoropyridine

Structural Information

Molecular Formula
C5H5FN2
SMILES
C1=CC(=NC=C1N)F
InChI
InChI=1S/C5H5FN2/c6-5-2-1-4(7)3-8-5/h1-3H,7H2
InChIKey
YTHMOBMZVVFNBE-UHFFFAOYSA-N
Compound name
6-fluoropyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1163
Patents

112.04368 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.050956 116.6
[M+Na]+ 135.032898 125.9
[M-H]- 111.036404 117.7
[M+NH4]+ 130.077503 137.7
[M+K]+ 151.006838 124.0
[M+H-H2O]+ 95.040940 109.8
[M+HCOO]- 157.041881 140.6
[M+CH3COO]- 171.057531 169.7
[M+Na-2H]- 133.018346 125.1
[M]+ 112.04313142 113.0
[M]- 112.04422858 113.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe