CID 4343024

N,n-diphenyl-2,4-xylenesulfonamide

Structural Information

Molecular Formula
C20H19NO2S
SMILES
CC1=CC(=C(C=C1)S(=O)(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C
InChI
InChI=1S/C20H19NO2S/c1-16-13-14-20(17(2)15-16)24(22,23)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-15H,1-2H3
InChIKey
ARTUANBTPJIFRI-UHFFFAOYSA-N
Compound name
2,4-dimethyl-N,N-diphenylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.11365 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.12093 178.6
[M+Na]+ 360.10287 186.1
[M-H]- 336.10637 189.8
[M+NH4]+ 355.14747 192.6
[M+K]+ 376.07681 181.1
[M+H-H2O]+ 320.11091 169.5
[M+HCOO]- 382.11185 197.9
[M+CH3COO]- 396.12750 213.1
[M+Na-2H]- 358.08832 182.4
[M]+ 337.11310 181.5
[M]- 337.11420 181.5
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.