CID 21708721

1h-indole-6-sulfonamide

Structural Information

Molecular Formula
C8H8N2O2S
SMILES
C1=CC(=CC2=C1C=CN2)S(=O)(=O)N
InChI
InChI=1S/C8H8N2O2S/c9-13(11,12)7-2-1-6-3-4-10-8(6)5-7/h1-5,10H,(H2,9,11,12)
InChIKey
AFJYOUBTIAOUQI-UHFFFAOYSA-N
Compound name
1H-indole-6-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

166
Patents

196.03065 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.03793 137.8
[M+Na]+ 219.01987 149.0
[M-H]- 195.02337 140.5
[M+NH4]+ 214.06447 158.4
[M+K]+ 234.99381 144.4
[M+H-H2O]+ 179.02791 132.8
[M+HCOO]- 241.02885 156.5
[M+CH3COO]- 255.04450 177.5
[M+Na-2H]- 217.00532 144.2
[M]+ 196.03010 139.1
[M]- 196.03120 139.1
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