CID 165521189

6-formyl-1h-indole-3-sulfonamide

Structural Information

Molecular Formula
C9H8N2O3S
SMILES
C1=CC2=C(C=C1C=O)NC=C2S(=O)(=O)N
InChI
InChI=1S/C9H8N2O3S/c10-15(13,14)9-4-11-8-3-6(5-12)1-2-7(8)9/h1-5,11H,(H2,10,13,14)
InChIKey
LFIJOBZZUIZKCN-UHFFFAOYSA-N
Compound name
6-formyl-1H-indole-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.02556 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.03284 144.9
[M+Na]+ 247.01478 156.5
[M-H]- 223.01828 147.8
[M+NH4]+ 242.05938 164.4
[M+K]+ 262.98872 151.7
[M+H-H2O]+ 207.02282 139.8
[M+HCOO]- 269.02376 163.6
[M+CH3COO]- 283.03941 183.1
[M+Na-2H]- 245.00023 150.3
[M]+ 224.02501 147.7
[M]- 224.02611 147.7
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.