CID 3340109
1-ethyl-3-methyl-1,3-dihydro-2h-benzimidazole-2-thione
Structural Information
- Molecular Formula
- C10H12N2S
- SMILES
- CCN1C2=CC=CC=C2N(C1=S)C
- InChI
- InChI=1S/C10H12N2S/c1-3-12-9-7-5-4-6-8(9)11(2)10(12)13/h4-7H,3H2,1-2H3
- InChIKey
- BLNDCZVBFRVGCN-UHFFFAOYSA-N
- Compound name
- 1-ethyl-3-methylbenzimidazole-2-thione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 193.07939 | 137.9 |
[M+Na]+ | 215.06133 | 151.3 |
[M-H]- | 191.06483 | 141.5 |
[M+NH4]+ | 210.10593 | 159.6 |
[M+K]+ | 231.03527 | 146.8 |
[M+H-H2O]+ | 175.06937 | 132.1 |
[M+HCOO]- | 237.07031 | 156.9 |
[M+CH3COO]- | 251.08596 | 152.7 |
[M+Na-2H]- | 213.04678 | 141.6 |
[M]+ | 192.07156 | 143.3 |
[M]- | 192.07266 | 143.3 |