CID 5333

Sulfanilamide

Structural Information

Molecular Formula
C6H8N2O2S
SMILES
C1=CC(=CC=C1N)S(=O)(=O)N
InChI
InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
InChIKey
FDDDEECHVMSUSB-UHFFFAOYSA-N
Compound name
4-aminobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

7574
References

65558
Patents

172.03065 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.03793 131.6
[M+Na]+ 195.01987 140.4
[M-H]- 171.02337 135.0
[M+NH4]+ 190.06447 151.4
[M+K]+ 210.99381 137.1
[M+H-H2O]+ 155.02791 126.0
[M+HCOO]- 217.02885 151.7
[M+CH3COO]- 231.04450 178.5
[M+Na-2H]- 193.00532 136.7
[M]+ 172.03010 130.2
[M]- 172.03120 130.2
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.