CID 3054012
Brn 1074432
Structural Information
- Molecular Formula
- C6H5N3O2S
- SMILES
- C1=CC2=C(NC=NS2(=O)=O)N=C1
- InChI
- InChI=1S/C6H5N3O2S/c10-12(11)5-2-1-3-7-6(5)8-4-9-12/h1-4H,(H,7,8,9)
- InChIKey
- XTJZVZARRFTFMX-UHFFFAOYSA-N
- Compound name
- 4H-pyrido[2,3-e][1,2,4]thiadiazine 1,1-dioxide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 184.01753 | 132.0 |
[M+Na]+ | 205.99947 | 143.4 |
[M-H]- | 182.00297 | 131.8 |
[M+NH4]+ | 201.04407 | 150.8 |
[M+K]+ | 221.97341 | 139.4 |
[M+H-H2O]+ | 166.00751 | 125.5 |
[M+HCOO]- | 228.00845 | 146.3 |
[M+CH3COO]- | 242.02410 | 144.9 |
[M+Na-2H]- | 203.98492 | 140.9 |
[M]+ | 183.00970 | 132.4 |
[M]- | 183.01080 | 132.4 |