CID 115012627

Ethyl2-(3-fluoroazetidin-3-yl)acetatehydrochloride

Structural Information

Molecular Formula
C7H12FNO2
SMILES
CCOC(=O)CC1(CNC1)F
InChI
InChI=1S/C7H12FNO2/c1-2-11-6(10)3-7(8)4-9-5-7/h9H,2-5H2,1H3
InChIKey
CONMAPUSAQSDCM-UHFFFAOYSA-N
Compound name
ethyl 2-(3-fluoroazetidin-3-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.0852 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.09248 138.1
[M+Na]+ 184.07442 142.3
[M+NH4]+ 179.11902 141.8
[M+K]+ 200.04836 137.9
[M-H]- 160.07792 133.2
[M+Na-2H]- 182.05987 139.7
[M]+ 161.08465 135.8
[M]- 161.08575 135.8
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.