CID 116091498

2-methyl-3-[1-(methylsulfanyl)propan-2-yl]imidazolidin-4-one

Structural Information

Molecular Formula
C8H16N2OS
SMILES
CC1NCC(=O)N1C(C)CSC
InChI
InChI=1S/C8H16N2OS/c1-6(5-12-3)10-7(2)9-4-8(10)11/h6-7,9H,4-5H2,1-3H3
InChIKey
BJEACEBFWLNDIS-UHFFFAOYSA-N
Compound name
2-methyl-3-(1-methylsulfanylpropan-2-yl)imidazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.09833 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.10561 144.4
[M+Na]+ 211.08755 153.0
[M+NH4]+ 206.13215 151.6
[M+K]+ 227.06149 148.1
[M-H]- 187.09105 143.6
[M+Na-2H]- 209.07300 145.7
[M]+ 188.09778 145.5
[M]- 188.09888 145.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.