CID 3040238

2-thiazolidinemethanol

Structural Information

Molecular Formula

SMILES

C1CSC(N1)CO

InChI

InChI=1S/C4H9NOS/c6-3-4-5-1-2-7-4/h4-6H,1-3H2

InChIKey

ILESGDFNOHPJBX-UHFFFAOYSA-N

Compound name

1,3-thiazolidin-2-ylmethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 33
Patents: 119.04048 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]+	120.04776	122.9
[M+Na]+	142.02970	131.5
[M+NH4]+	137.07430	131.6
[M+K]+	158.00364	126.5
[M-H]-	118.03320	122.9
[M+Na-2H]-	140.01515	125.9
[M]+	119.03993	124.2
[M]-	119.04103	124.2

Literature stripe

literature stripe

Patent stripe

patents stripe