CID 10011854

3-fluoropyrrolidin-2-one

Structural Information

Molecular Formula
C4H6FNO
SMILES
C1CNC(=O)C1F
InChI
InChI=1S/C4H6FNO/c5-3-1-2-6-4(3)7/h3H,1-2H2,(H,6,7)
InChIKey
OPUUXPIAXCZUOB-UHFFFAOYSA-N
Compound name
3-fluoropyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

103.04334 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 104.05062 119.2
[M+Na]+ 126.03256 128.5
[M+NH4]+ 121.07716 126.9
[M+K]+ 142.00650 125.3
[M-H]- 102.03606 117.8
[M+Na-2H]- 124.01801 122.7
[M]+ 103.04279 119.7
[M]- 103.04389 119.7
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

patents stripe