CID 12142411

2,3-dioxo-2,3-dihydro-1h-indole-5-sulfonamide

Structural Information

Molecular Formula
C8H6N2O4S
SMILES
C1=CC2=C(C=C1S(=O)(=O)N)C(=O)C(=O)N2
InChI
InChI=1S/C8H6N2O4S/c9-15(13,14)4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3H,(H2,9,13,14)(H,10,11,12)
InChIKey
KHHJNWWJDYSSRK-UHFFFAOYSA-N
Compound name
2,3-dioxo-1H-indole-5-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

36
Patents

226.00482 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.01210 144.2
[M+Na]+ 248.99404 154.9
[M-H]- 224.99754 146.7
[M+NH4]+ 244.03864 163.5
[M+K]+ 264.96798 150.8
[M+H-H2O]+ 209.00208 139.6
[M+HCOO]- 271.00302 160.6
[M+CH3COO]- 285.01867 183.4
[M+Na-2H]- 246.97949 148.0
[M]+ 226.00427 144.9
[M]- 226.00537 144.9
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

patents stripe