CID 155973465

4-nitroso-1lambda6-thiomorpholine-1,1-dione

Structural Information

Molecular Formula
C4H8N2O3S
SMILES
C1CS(=O)(=O)CCN1N=O
InChI
InChI=1S/C4H8N2O3S/c7-5-6-1-3-10(8,9)4-2-6/h1-4H2
InChIKey
BFISQPALYIVBKK-UHFFFAOYSA-N
Compound name
4-nitroso-1,4-thiazinane 1,1-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.02556 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.03284 130.9
[M+Na]+ 187.01478 140.6
[M+NH4]+ 182.05938 139.9
[M+K]+ 202.98872 132.4
[M-H]- 163.01828 131.6
[M+Na-2H]- 185.00023 136.8
[M]+ 164.02501 132.7
[M]- 164.02611 132.7
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.