CID 74568

N-ethyl-4-methyl-n-phenylbenzenesulfonamide

Structural Information

Molecular Formula
C15H17NO2S
SMILES
CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C
InChI
InChI=1S/C15H17NO2S/c1-3-16(14-7-5-4-6-8-14)19(17,18)15-11-9-13(2)10-12-15/h4-12H,3H2,1-2H3
InChIKey
IXLBWOFLBSGRAP-UHFFFAOYSA-N
Compound name
N-ethyl-4-methyl-N-phenylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

20
Patents

275.098 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.105276 161.4
[M+Na]+ 298.087218 168.9
[M-H]- 274.090724 169.7
[M+NH4]+ 293.131823 178.3
[M+K]+ 314.061158 165.4
[M+H-H2O]+ 258.095260 153.8
[M+HCOO]- 320.096201 181.1
[M+CH3COO]- 334.111851 201.0
[M+Na-2H]- 296.072666 165.8
[M]+ 275.09745142 164.9
[M]- 275.09854858 164.9
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