CID 3047404
1,3,4-thiadiazole-2-thiol, 5-dimethylamino-, hydrochloride
Structural Information
- Molecular Formula
- C4H7N3S2
- SMILES
- CN(C)C1=NNC(=S)S1
- InChI
- InChI=1S/C4H7N3S2/c1-7(2)3-5-6-4(8)9-3/h1-2H3,(H,6,8)
- InChIKey
- PKNMLXOFZGQTFC-UHFFFAOYSA-N
- Compound name
- 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 162.01541 | 127.8 |
[M+Na]+ | 183.99735 | 138.2 |
[M-H]- | 160.00085 | 129.7 |
[M+NH4]+ | 179.04195 | 148.6 |
[M+K]+ | 199.97129 | 135.0 |
[M+H-H2O]+ | 144.00539 | 121.8 |
[M+HCOO]- | 206.00633 | 141.1 |
[M+CH3COO]- | 220.02198 | 176.5 |
[M+Na-2H]- | 181.98280 | 128.5 |
[M]+ | 161.00758 | 129.1 |
[M]- | 161.00868 | 129.1 |