CID 54594897

Methyl 2-[(6-fluoropyridin-2-yl)amino]acetate

Structural Information

Molecular Formula
C8H9FN2O2
SMILES
COC(=O)CNC1=NC(=CC=C1)F
InChI
InChI=1S/C8H9FN2O2/c1-13-8(12)5-10-7-4-2-3-6(9)11-7/h2-4H,5H2,1H3,(H,10,11)
InChIKey
JSZRDNBBEMPWGQ-UHFFFAOYSA-N
Compound name
methyl 2-[(6-fluoropyridin-2-yl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.0648 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.07208 135.6
[M+Na]+ 207.05402 143.6
[M-H]- 183.05752 136.8
[M+NH4]+ 202.09862 153.9
[M+K]+ 223.02796 142.2
[M+H-H2O]+ 167.06206 127.8
[M+HCOO]- 229.06300 158.9
[M+CH3COO]- 243.07865 182.9
[M+Na-2H]- 205.03947 142.2
[M]+ 184.06425 135.6
[M]- 184.06535 135.6
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.