CID 74367

N,n-diethylbenzenesulfonamide

Structural Information

Molecular Formula
C10H15NO2S
SMILES
CCN(CC)S(=O)(=O)C1=CC=CC=C1
InChI
InChI=1S/C10H15NO2S/c1-3-11(4-2)14(12,13)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3
InChIKey
FZIFUJULXRFHBB-UHFFFAOYSA-N
Compound name
N,N-diethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

385
Patents

213.08235 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.08963 145.3
[M+Na]+ 236.07157 152.5
[M-H]- 212.07507 150.4
[M+NH4]+ 231.11617 164.8
[M+K]+ 252.04551 150.7
[M+H-H2O]+ 196.07961 138.9
[M+HCOO]- 258.08055 164.9
[M+CH3COO]- 272.09620 189.2
[M+Na-2H]- 234.05702 150.0
[M]+ 213.08180 149.1
[M]- 213.08290 149.1
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