CID 26036

1,3-dimethylimidazolidine-2-thione

Structural Information

Molecular Formula
C5H10N2S
SMILES
CN1CCN(C1=S)C
InChI
InChI=1S/C5H10N2S/c1-6-3-4-7(2)5(6)8/h3-4H2,1-2H3
InChIKey
FYHIXFCITOCVKH-UHFFFAOYSA-N
Compound name
1,3-dimethylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1579
Patents

130.05647 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.06375 125.2
[M+Na]+ 153.04569 134.9
[M-H]- 129.04919 126.7
[M+NH4]+ 148.09029 147.6
[M+K]+ 169.01963 133.4
[M+H-H2O]+ 113.05373 119.5
[M+HCOO]- 175.05467 141.3
[M+CH3COO]- 189.07032 170.8
[M+Na-2H]- 151.03114 125.9
[M]+ 130.05592 124.9
[M]- 130.05702 124.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe