CID 2851717

66335-85-1

Structural Information

Molecular Formula

C₉H₁₇NO₃S

SMILES

C1CCN(CC1)C2CS(=O)(=O)CC2O

InChI

InChI=1S/C9H17NO3S/c11-9-7-14(12,13)6-8(9)10-4-2-1-3-5-10/h8-9,11H,1-7H2

InChIKey

SNEPMRMWHXCLPC-UHFFFAOYSA-N

Compound name

1,1-dioxo-4-piperidin-1-ylthiolan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 9
References: 0
Patents: 219.09291 Da
Monoisotopic Mass: -0.3
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]+	220.10019	148.2
[M+Na]+	242.08213	156.6
[M+NH4]+	237.12673	157.3
[M+K]+	258.05607	149.8
[M-H]-	218.08563	149.3
[M+Na-2H]-	240.06758	152.5
[M]+	219.09236	149.9
[M]-	219.09346	149.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.