CID 3015815

5-vinylthiazolidin-2-one

Structural Information

Molecular Formula

SMILES

C=CC1CNC(=O)S1

InChI

InChI=1S/C5H7NOS/c1-2-4-3-6-5(7)8-4/h2,4H,1,3H2,(H,6,7)

InChIKey

JJKPQDFLJFVJKO-UHFFFAOYSA-N

Compound name

5-ethenyl-1,3-thiazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 129.02484 Da
Monoisotopic Mass: 0.9
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]+	130.032116	124.9
[M+Na]+	152.014058	133.4
[M-H]-	128.017564	126.1
[M+NH4]+	147.058663	147.4
[M+K]+	167.987998	130.7
[M+H-H2O]+	112.022100	120.0
[M+HCOO]-	174.023041	141.1
[M+CH3COO]-	188.038691	165.3
[M+Na-2H]-	149.999506	126.0
[M]+	129.02429142	122.6
[M]-	129.02538858	122.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.