CID 165943620

2703756-10-7

Structural Information

Molecular Formula

C₅H₁₁NO₂S

SMILES

CS(=N)(=O)C1CC(C1)O

InChI

InChI=1S/C5H11NO2S/c1-9(6,8)5-2-4(7)3-5/h4-7H,2-3H2,1H3

InChIKey

MIHURTSKGKPFAH-UHFFFAOYSA-N

Compound name

3-(methylsulfonimidoyl)cyclobutan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 149.05106 Da
Monoisotopic Mass: 0.8
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]+	150.05834	129.1
[M+Na]+	172.04028	133.0
[M+NH4]+	167.08488	132.7
[M+K]+	188.01422	129.8
[M-H]-	148.04378	126.3
[M+Na-2H]-	170.02573	129.8
[M]+	149.05051	127.8
[M]-	149.05161	127.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.