CID 2723650

Imidazolidine-2-thione

Structural Information

Molecular Formula
C3H6N2S
SMILES
C1CNC(=S)N1
InChI
InChI=1S/C3H6N2S/c6-3-4-1-2-5-3/h1-2H2,(H2,4,5,6)
InChIKey
PDQAZBWRQCGBEV-UHFFFAOYSA-N
Compound name
imidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

385
References

25036
Patents

102.02517 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.03245 118.7
[M+Na]+ 125.01439 126.6
[M-H]- 101.01789 117.0
[M+NH4]+ 120.05899 140.1
[M+K]+ 140.98833 123.8
[M+H-H2O]+ 85.022430 113.2
[M+HCOO]- 147.02337 132.4
[M+CH3COO]- 161.03902 157.2
[M+Na-2H]- 122.99984 120.7
[M]+ 102.02462 113.2
[M]- 102.02572 113.2
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.