CID 3006164

5-methylthiazolidine-2-thione

Structural Information

Molecular Formula
C4H7NS2
SMILES
CC1CNC(=S)S1
InChI
InChI=1S/C4H7NS2/c1-3-2-5-4(6)7-3/h3H,2H2,1H3,(H,5,6)
InChIKey
OIKWJUAGJHMOOM-UHFFFAOYSA-N
Compound name
5-methyl-1,3-thiazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

90
Patents

133.002 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.00928 123.3
[M+Na]+ 155.99122 132.3
[M-H]- 131.99472 124.5
[M+NH4]+ 151.03582 146.0
[M+K]+ 171.96516 128.8
[M+H-H2O]+ 115.99926 118.8
[M+HCOO]- 178.00020 133.7
[M+CH3COO]- 192.01585 166.5
[M+Na-2H]- 153.97667 122.4
[M]+ 133.00145 121.0
[M]- 133.00255 121.0
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.