CID 2345617

6-(diethylsulfamoyl)-2-hydroxyquinoline-4-carboxylic acid

Structural Information

Molecular Formula
C14H16N2O5S
SMILES
CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)C=C2C(=O)O
InChI
InChI=1S/C14H16N2O5S/c1-3-16(4-2)22(20,21)9-5-6-12-10(7-9)11(14(18)19)8-13(17)15-12/h5-8H,3-4H2,1-2H3,(H,15,17)(H,18,19)
InChIKey
ZLCXXWQTSCMBKW-UHFFFAOYSA-N
Compound name
6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

324.078 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.08528 170.2
[M+Na]+ 347.06722 180.0
[M+NH4]+ 342.11182 174.9
[M+K]+ 363.04116 175.0
[M-H]- 323.07072 169.1
[M+Na-2H]- 345.05267 173.2
[M]+ 324.07745 171.4
[M]- 324.07855 171.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.