CID 262999

N-(2,6-dimethylphenyl)-4-methylbenzenesulfonamide

Structural Information

Molecular Formula
C15H17NO2S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC=C2C)C
InChI
InChI=1S/C15H17NO2S/c1-11-7-9-14(10-8-11)19(17,18)16-15-12(2)5-4-6-13(15)3/h4-10,16H,1-3H3
InChIKey
SEYRJIDJWCOIBS-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

39
Patents

275.098 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.105276 160.9
[M+Na]+ 298.087218 169.9
[M-H]- 274.090724 168.4
[M+NH4]+ 293.131823 177.7
[M+K]+ 314.061158 165.0
[M+H-H2O]+ 258.095260 153.8
[M+HCOO]- 320.096201 179.9
[M+CH3COO]- 334.111851 200.0
[M+Na-2H]- 296.072666 164.6
[M]+ 275.09745142 163.9
[M]- 275.09854858 163.9
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

patents stripe