CID 132342018

Methyl 6-(fluorosulfonyl)pyridine-2-carboxylate

Structural Information

Molecular Formula
C7H6FNO4S
SMILES
COC(=O)C1=NC(=CC=C1)S(=O)(=O)F
InChI
InChI=1S/C7H6FNO4S/c1-13-7(10)5-3-2-4-6(9-5)14(8,11)12/h2-4H,1H3
InChIKey
XUFYKHRMTXWMST-UHFFFAOYSA-N
Compound name
methyl 6-fluorosulfonylpyridine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.00015 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.00743 143.8
[M+Na]+ 241.98937 154.1
[M+NH4]+ 237.03397 149.4
[M+K]+ 257.96331 148.7
[M-H]- 217.99287 141.4
[M+Na-2H]- 239.97482 147.9
[M]+ 218.99960 144.7
[M]- 219.00070 144.7
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

No patent data available for this compound.