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]+ 228.10528 149.9
[M+Na]+ 250.08722 155.8
[M-H]- 226.09072 153.4
[M+NH4]+ 245.13182 168.0
[M+K]+ 266.06116 153.4
[M+H-H2O]+ 210.09526 143.7
[M+HCOO]- 272.09620 166.6
[M+CH3COO]- 286.11185 190.4
[M+Na-2H]- 248.07267 152.6
[M]+ 227.09745 151.6
[M]- 227.09855 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.