CID 3034192
N,n-dimethylthiourea
Structural Information
- Molecular Formula
- C3H8N2S
- SMILES
- CN(C)C(=S)N
- InChI
- InChI=1S/C3H8N2S/c1-5(2)3(4)6/h1-2H3,(H2,4,6)
- InChIKey
- ZQGWBPQBZHMUFG-UHFFFAOYSA-N
- Compound name
- 1,1-dimethylthiourea
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 105.04810 | 119.2 |
[M+Na]+ | 127.03004 | 126.2 |
[M-H]- | 103.03354 | 121.0 |
[M+NH4]+ | 122.07464 | 142.5 |
[M+K]+ | 143.00398 | 126.2 |
[M+H-H2O]+ | 87.038080 | 113.9 |
[M+HCOO]- | 149.03902 | 139.1 |
[M+CH3COO]- | 163.05467 | 173.6 |
[M+Na-2H]- | 125.01549 | 121.7 |
[M]+ | 104.04027 | 118.5 |
[M]- | 104.04137 | 118.5 |