CID 53516552

N-cycloheptyl-n-methylmethanesulfonamide

Structural Information

Molecular Formula

C₉H₁₉NO₂S

SMILES

CN(C1CCCCCC1)S(=O)(=O)C

InChI

InChI=1S/C9H19NO2S/c1-10(13(2,11)12)9-7-5-3-4-6-8-9/h9H,3-8H2,1-2H3

InChIKey

UXPPTRFZLSZETL-UHFFFAOYSA-N

Compound name

N-cycloheptyl-N-methylmethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 205.11365 Da
Monoisotopic Mass: 1.9
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]+	206.12093	145.5
[M+Na]+	228.10287	151.9
[M+NH4]+	223.14747	152.7
[M+K]+	244.07681	147.3
[M-H]-	204.10637	146.5
[M+Na-2H]-	226.08832	149.2
[M]+	205.11310	146.9
[M]-	205.11420	146.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.