CID 286385

Nsc144472

Structural Information

Molecular Formula
C26H28N2O4S2
SMILES
CC1(C=CC(C2=C(C=CC(=C21)NS(=O)(=O)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4)(C)C)C
InChI
InChI=1S/C26H28N2O4S2/c1-25(2)17-18-26(3,4)24-22(28-34(31,32)20-13-9-6-10-14-20)16-15-21(23(24)25)27-33(29,30)19-11-7-5-8-12-19/h5-18,27-28H,1-4H3
InChIKey
DVYVRPXBKYPNNB-UHFFFAOYSA-N
Compound name
N-[4-(benzenesulfonamido)-5,5,8,8-tetramethylnaphthalen-1-yl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

496.14905 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 497.15633 214.5
[M+Na]+ 519.13827 221.4
[M-H]- 495.14177 222.9
[M+NH4]+ 514.18287 225.5
[M+K]+ 535.11221 214.9
[M+H-H2O]+ 479.14631 205.7
[M+HCOO]- 541.14725 224.0
[M+CH3COO]- 555.16290 239.3
[M+Na-2H]- 517.12372 223.5
[M]+ 496.14850 218.4
[M]- 496.14960 218.4
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.