CID 137949003

N,2-dimethyl-1-phenylpropane-1-sulfonamide

Structural Information

Molecular Formula
C11H17NO2S
SMILES
CC(C)C(C1=CC=CC=C1)S(=O)(=O)NC
InChI
InChI=1S/C11H17NO2S/c1-9(2)11(15(13,14)12-3)10-7-5-4-6-8-10/h4-9,11-12H,1-3H3
InChIKey
XLBJNONNGDNDHM-UHFFFAOYSA-N
Compound name
N,2-dimethyl-1-phenylpropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.098 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.105276 149.9
[M+Na]+ 250.087218 155.8
[M-H]- 226.090724 153.4
[M+NH4]+ 245.131823 168.0
[M+K]+ 266.061158 153.4
[M+H-H2O]+ 210.095260 143.7
[M+HCOO]- 272.096201 166.6
[M+CH3COO]- 286.111851 190.4
[M+Na-2H]- 248.072666 152.6
[M]+ 227.09745142 151.6
[M]- 227.09854858 151.6
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.