CID 114958876

6-(sulfamoylamino)pyridine-2-carboxylic acid

Structural Information

Molecular Formula
C6H7N3O4S
SMILES
C1=CC(=NC(=C1)NS(=O)(=O)N)C(=O)O
InChI
InChI=1S/C6H7N3O4S/c7-14(12,13)9-5-3-1-2-4(8-5)6(10)11/h1-3H,(H,8,9)(H,10,11)(H2,7,12,13)
InChIKey
OAEDQMLMMPSUAR-UHFFFAOYSA-N
Compound name
6-(sulfamoylamino)pyridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

217.01573 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.02301 142.2
[M+Na]+ 240.00495 150.1
[M+NH4]+ 235.04955 147.2
[M+K]+ 255.97889 146.6
[M-H]- 216.00845 141.0
[M+Na-2H]- 237.99040 145.8
[M]+ 217.01518 142.9
[M]- 217.01628 142.9
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

patents stripe