CID 165726908

2742657-62-9

Structural Information

Molecular Formula
C6H10FNO4S
SMILES
C1CC(CN(C1)S(=O)(=O)F)C(=O)O
InChI
InChI=1S/C6H10FNO4S/c7-13(11,12)8-3-1-2-5(4-8)6(9)10/h5H,1-4H2,(H,9,10)
InChIKey
NHVSGUVKNULCSJ-UHFFFAOYSA-N
Compound name
1-fluorosulfonylpiperidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.03146 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.03874 139.6
[M+Na]+ 234.02068 146.2
[M-H]- 210.02418 138.9
[M+NH4]+ 229.06528 156.4
[M+K]+ 249.99462 144.4
[M+H-H2O]+ 194.02872 133.4
[M+HCOO]- 256.02966 150.5
[M+CH3COO]- 270.04531 178.0
[M+Na-2H]- 232.00613 141.4
[M]+ 211.03091 136.8
[M]- 211.03201 136.8
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.