CID 165992483
1lambda6,2,7-thiadiazonane-1,1,6-trione
Structural Information
- Molecular Formula
- C6H12N2O3S
- SMILES
- C1CC(=O)NCCS(=O)(=O)NC1
- InChI
- InChI=1S/C6H12N2O3S/c9-6-2-1-3-8-12(10,11)5-4-7-6/h8H,1-5H2,(H,7,9)
- InChIKey
- KUPDPZXHYRJTOE-UHFFFAOYSA-N
- Compound name
- 1,1-dioxo-1,2,7-thiadiazonan-6-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 193.06415 | 193.5 |
[M+Na]+ | 215.04609 | 196.1 |
[M-H]- | 191.04959 | 193.7 |
[M+NH4]+ | 210.09069 | 194.0 |
[M+K]+ | 231.02003 | 193.6 |
[M+H-H2O]+ | 175.05413 | 185.5 |
[M+HCOO]- | 237.05507 | 194.6 |
[M+CH3COO]- | 251.07072 | 195.3 |
[M+Na-2H]- | 213.03154 | 196.2 |
[M]+ | 192.05632 | 194.2 |
[M]- | 192.05742 | 194.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.