CID 5272989

N-[2-[[2-(benzenesulfonamido)phenyl]diselanyl]phenyl]benzenesulfonamide

Structural Information

Molecular Formula
C24H20N2O4S2Se2
SMILES
C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2[Se][Se]C3=CC=CC=C3NS(=O)(=O)C4=CC=CC=C4
InChI
InChI=1S/C24H20N2O4S2Se2/c27-31(28,19-11-3-1-4-12-19)25-21-15-7-9-17-23(21)33-34-24-18-10-8-16-22(24)26-32(29,30)20-13-5-2-6-14-20/h1-18,25-26H
InChIKey
BQDLUSVXDFHNTR-UHFFFAOYSA-N
Compound name
N-[2-[[2-(benzenesulfonamido)phenyl]diselanyl]phenyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

623.9195 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 624.92678 236.3
[M+Na]+ 646.90872 240.3
[M-H]- 622.91222 245.9
[M+NH4]+ 641.95332 240.7
[M+K]+ 662.88266 231.4
[M+H-H2O]+ 606.91676 224.4
[M+HCOO]- 668.91770 247.8
[M+CH3COO]- 682.93335 240.1
[M+Na-2H]- 644.89417 240.3
[M]+ 623.91895 237.4
[M]- 623.92005 237.4
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.