CID 138991423

1-(fluorosulfonyl)azetidine-3-carboxylic acid

Structural Information

Molecular Formula
C4H6FNO4S
SMILES
C1C(CN1S(=O)(=O)F)C(=O)O
InChI
InChI=1S/C4H6FNO4S/c5-11(9,10)6-1-3(2-6)4(7)8/h3H,1-2H2,(H,7,8)
InChIKey
GWFTZGBECWDCEP-UHFFFAOYSA-N
Compound name
1-fluorosulfonylazetidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.00015 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.00743 136.7
[M+Na]+ 205.98937 139.7
[M+NH4]+ 201.03397 137.8
[M+K]+ 221.96331 138.0
[M-H]- 181.99287 129.9
[M+Na-2H]- 203.97482 135.2
[M]+ 182.99960 133.9
[M]- 183.00070 133.9
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.