CID 54594700

Ethyl 2-[(5-fluoropyridin-2-yl)amino]acetate

Structural Information

Molecular Formula
C9H11FN2O2
SMILES
CCOC(=O)CNC1=NC=C(C=C1)F
InChI
InChI=1S/C9H11FN2O2/c1-2-14-9(13)6-12-8-4-3-7(10)5-11-8/h3-5H,2,6H2,1H3,(H,11,12)
InChIKey
BLRPJCSCDVNVJB-UHFFFAOYSA-N
Compound name
ethyl 2-[(5-fluoropyridin-2-yl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.08046 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.08774 141.4
[M+Na]+ 221.06968 152.0
[M+NH4]+ 216.11428 147.9
[M+K]+ 237.04362 146.6
[M-H]- 197.07318 141.2
[M+Na-2H]- 219.05513 147.0
[M]+ 198.07991 142.5
[M]- 198.08101 142.5
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.