CID 39870930

Methyl 2-chloro-5-sulfamoylpyridine-3-carboxylate

Structural Information

Molecular Formula
C7H7ClN2O4S
SMILES
COC(=O)C1=C(N=CC(=C1)S(=O)(=O)N)Cl
InChI
InChI=1S/C7H7ClN2O4S/c1-14-7(11)5-2-4(15(9,12)13)3-10-6(5)8/h2-3H,1H3,(H2,9,12,13)
InChIKey
INZLQXFFGGMVRU-UHFFFAOYSA-N
Compound name
methyl 2-chloro-5-sulfamoylpyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.9815 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.98878 149.8
[M+Na]+ 272.97072 160.7
[M+NH4]+ 268.01532 155.8
[M+K]+ 288.94466 155.3
[M-H]- 248.97422 149.1
[M+Na-2H]- 270.95617 153.9
[M]+ 249.98095 151.6
[M]- 249.98205 151.6
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.