CID 105427707

2-(azetidin-3-yl)-2-fluoroacetic acid hydrochloride

Structural Information

Molecular Formula
C5H8FNO2
SMILES
C1C(CN1)C(C(=O)O)F
InChI
InChI=1S/C5H8FNO2/c6-4(5(8)9)3-1-7-2-3/h3-4,7H,1-2H2,(H,8,9)
InChIKey
GLIZPVGFQMDMHL-UHFFFAOYSA-N
Compound name
2-(azetidin-3-yl)-2-fluoroacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.05391 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.06119 127.4
[M+Na]+ 156.04313 132.1
[M-H]- 132.04663 125.3
[M+NH4]+ 151.08773 139.6
[M+K]+ 172.01707 134.0
[M+H-H2O]+ 116.05117 115.9
[M+HCOO]- 178.05211 143.1
[M+CH3COO]- 192.06776 170.7
[M+Na-2H]- 154.02858 130.2
[M]+ 133.05336 130.4
[M]- 133.05446 130.4
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.