CID 43210686

1251924-22-7

Structural Information

Molecular Formula
C8H14N2OS2
SMILES
C1CSCCN1C(=O)C2CSCN2
InChI
InChI=1S/C8H14N2OS2/c11-8(7-5-13-6-9-7)10-1-3-12-4-2-10/h7,9H,1-6H2
InChIKey
BKNGVTWIZZPKBB-UHFFFAOYSA-N
Compound name
1,3-thiazolidin-4-yl(thiomorpholin-4-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.05475 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.06203 146.4
[M+Na]+ 241.04397 151.1
[M-H]- 217.04747 147.7
[M+NH4]+ 236.08857 163.6
[M+K]+ 257.01791 147.7
[M+H-H2O]+ 201.05201 140.1
[M+HCOO]- 263.05295 151.4
[M+CH3COO]- 277.06860 156.1
[M+Na-2H]- 239.02942 143.3
[M]+ 218.05420 140.1
[M]- 218.05530 140.1
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.