CID 126836057

2059993-07-4

Structural Information

Molecular Formula
C7H12N2O3S
SMILES
C1CCN2C(C1)CS(=O)(=O)NC2=O
InChI
InChI=1S/C7H12N2O3S/c10-7-8-13(11,12)5-6-3-1-2-4-9(6)7/h6H,1-5H2,(H,8,10)
InChIKey
FJDYYARJTYMDET-UHFFFAOYSA-N
Compound name
2,2-dioxo-1,6,7,8,9,9a-hexahydropyrido[1,2-d][1,2,4]thiadiazin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.05687 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.06415 139.8
[M+Na]+ 227.04609 147.3
[M-H]- 203.04959 139.5
[M+NH4]+ 222.09069 158.8
[M+K]+ 243.02003 144.3
[M+H-H2O]+ 187.05413 134.1
[M+HCOO]- 249.05507 149.5
[M+CH3COO]- 263.07072 177.0
[M+Na-2H]- 225.03154 144.0
[M]+ 204.05632 135.7
[M]- 204.05742 135.7
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.