CID 44725406
5-(piperidin-1-yl)-1,3,4-thiadiazole-2-thiol
Structural Information
- Molecular Formula
- C7H11N3S2
- SMILES
- C1CCN(CC1)C2=NNC(=S)S2
- InChI
- InChI=1S/C7H11N3S2/c11-7-9-8-6(12-7)10-4-2-1-3-5-10/h1-5H2,(H,9,11)
- InChIKey
- NXYCCXNQSGLOHM-UHFFFAOYSA-N
- Compound name
- 5-piperidin-1-yl-3H-1,3,4-thiadiazole-2-thione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 202.04672 | 138.8 |
[M+Na]+ | 224.02866 | 147.8 |
[M-H]- | 200.03216 | 140.1 |
[M+NH4]+ | 219.07326 | 156.1 |
[M+K]+ | 240.00260 | 142.7 |
[M+H-H2O]+ | 184.03670 | 132.4 |
[M+HCOO]- | 246.03764 | 146.7 |
[M+CH3COO]- | 260.05329 | 150.1 |
[M+Na-2H]- | 222.01411 | 137.9 |
[M]+ | 201.03889 | 135.1 |
[M]- | 201.03999 | 135.1 |
Literature stripe
No literature data available for this compound.