CID 818647

24310-30-3

Structural Information

Molecular Formula
C19H17NO2S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C3=CC=CC=C3
InChI
InChI=1S/C19H17NO2S/c1-15-11-13-17(14-12-15)23(21,22)20-19-10-6-5-9-18(19)16-7-3-2-4-8-16/h2-14,20H,1H3
InChIKey
VPIDANAIZIMNGX-UHFFFAOYSA-N
Compound name
4-methyl-N-(2-phenylphenyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

13
Patents

323.098 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.10528 174.2
[M+Na]+ 346.08722 182.1
[M-H]- 322.09072 184.2
[M+NH4]+ 341.13182 188.2
[M+K]+ 362.06116 175.8
[M+H-H2O]+ 306.09526 165.6
[M+HCOO]- 368.09620 193.4
[M+CH3COO]- 382.11185 206.9
[M+Na-2H]- 344.07267 179.2
[M]+ 323.09745 175.5
[M]- 323.09855 175.5
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.