CID 6481340

Benzenesulfonamide, 4,4'-oxybis[n-(3-methylphenyl)-

Structural Information

Molecular Formula
C26H24N2O5S2
SMILES
CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC(=C4)C
InChI
InChI=1S/C26H24N2O5S2/c1-19-5-3-7-21(17-19)27-34(29,30)25-13-9-23(10-14-25)33-24-11-15-26(16-12-24)35(31,32)28-22-8-4-6-20(2)18-22/h3-18,27-28H,1-2H3
InChIKey
FXVSQCXRZWGFME-UHFFFAOYSA-N
Compound name
N-(3-methylphenyl)-4-[4-[(3-methylphenyl)sulfamoyl]phenoxy]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

508.11267 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 509.11995 219.3
[M+Na]+ 531.10189 225.2
[M-H]- 507.10539 230.6
[M+NH4]+ 526.14649 224.6
[M+K]+ 547.07583 217.9
[M+H-H2O]+ 491.10993 208.5
[M+HCOO]- 553.11087 232.1
[M+CH3COO]- 567.12652 240.5
[M+Na-2H]- 529.08734 224.6
[M]+ 508.11212 222.8
[M]- 508.11322 222.8
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.