CID 15276766

174466-64-9

Structural Information

Molecular Formula
C5H10N2O3S
SMILES
CC(C)[C@H]1C(=O)NS(=O)(=O)N1
InChI
InChI=1S/C5H10N2O3S/c1-3(2)4-5(8)7-11(9,10)6-4/h3-4,6H,1-2H3,(H,7,8)/t4-/m0/s1
InChIKey
ARGDYBLGWYGDMM-BYPYZUCNSA-N
Compound name
(4S)-1,1-dioxo-4-propan-2-yl-1,2,5-thiadiazolidin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.04121 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.048486 133.6
[M+Na]+ 201.030428 142.9
[M-H]- 177.033934 132.5
[M+NH4]+ 196.075033 154.1
[M+K]+ 217.004368 140.3
[M+H-H2O]+ 161.038470 129.4
[M+HCOO]- 223.039411 146.6
[M+CH3COO]- 237.055061 170.6
[M+Na-2H]- 199.015876 134.3
[M]+ 178.04066142 132.3
[M]- 178.04175858 132.3
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.