CID 55280579

2-fluoro-6-methoxypyridine-3-sulfonylchloride

Structural Information

Molecular Formula
C6H5ClFNO3S
SMILES
COC1=NC(=C(C=C1)S(=O)(=O)Cl)F
InChI
InChI=1S/C6H5ClFNO3S/c1-12-5-3-2-4(6(8)9-5)13(7,10)11/h2-3H,1H3
InChIKey
LXUBOFBVOHIFPM-UHFFFAOYSA-N
Compound name
2-fluoro-6-methoxypyridine-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.96626 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.97354 141.8
[M+Na]+ 247.95548 154.1
[M+NH4]+ 243.00008 148.8
[M+K]+ 263.92942 147.2
[M-H]- 223.95898 140.5
[M+Na-2H]- 245.94093 146.9
[M]+ 224.96571 143.8
[M]- 224.96681 143.8
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.