CID 155819956

2470438-54-9

Structural Information

Molecular Formula

C₇H₁₅NO₂S

SMILES

CS(=N)(=O)CCC1CC(C1)O

InChI

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

InChIKey

XGOPBSJCOHDKTK-UHFFFAOYSA-N

Compound name

3-[2-(methylsulfonimidoyl)ethyl]cyclobutan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 177.08235 Da
Monoisotopic Mass: 1.4
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	137.7
[M+Na]+	200.07157	141.1
[M+NH4]+	195.11617	140.9
[M+K]+	216.04551	137.5
[M-H]-	176.07507	134.7
[M+Na-2H]-	198.05702	137.9
[M]+	177.08180	136.3
[M]-	177.08290	136.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.