CID 344191

4-amino-n-cyclohexyl-n-methylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C13H20N2O2S
SMILES
CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C13H20N2O2S/c1-15(12-5-3-2-4-6-12)18(16,17)13-9-7-11(14)8-10-13/h7-10,12H,2-6,14H2,1H3
InChIKey
BIWPQNWGSVWCPP-UHFFFAOYSA-N
Compound name
4-amino-N-cyclohexyl-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

2
Patents

268.12454 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.13182 159.2
[M+Na]+ 291.11376 163.4
[M-H]- 267.11726 165.8
[M+NH4]+ 286.15836 175.4
[M+K]+ 307.08770 160.5
[M+H-H2O]+ 251.12180 151.7
[M+HCOO]- 313.12274 175.4
[M+CH3COO]- 327.13839 200.5
[M+Na-2H]- 289.09921 161.5
[M]+ 268.12399 156.1
[M]- 268.12509 156.1
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