CID 344191

7467-48-3

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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	269.13182	159.1
[M+Na]+	291.11376	168.2
[M+NH4]+	286.15836	167.1
[M+K]+	307.08770	161.3
[M-H]-	267.11726	163.2
[M+Na-2H]-	289.09921	165.6
[M]+	268.12399	161.8
[M]-	268.12509	161.8

Literature stripe

literature stripe

Patent stripe

patents stripe