CID 50987784

4-methylcyclohexane-1-sulfonamide

Structural Information

Molecular Formula

C₇H₁₅NO₂S

SMILES

CC1CCC(CC1)S(=O)(=O)N

InChI

InChI=1S/C7H15NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h6-7H,2-5H2,1H3,(H2,8,9,10)

InChIKey

GWRYNBJTZAHSDO-UHFFFAOYSA-N

Compound name

4-methylcyclohexane-1-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 177.08235 Da
Monoisotopic Mass: 1.0
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]+	178.08963	137.1
[M+Na]+	200.07157	145.6
[M+NH4]+	195.11617	145.2
[M+K]+	216.04551	139.5
[M-H]-	176.07507	138.1
[M+Na-2H]-	198.05702	140.6
[M]+	177.08180	138.8
[M]-	177.08290	138.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe