CID 348494
22816-60-0
Structural Information
- Molecular Formula
- C8H8Cl2N2S
- SMILES
- C1=CC(=C(C=C1CSC(=N)N)Cl)Cl
- InChI
- InChI=1S/C8H8Cl2N2S/c9-6-2-1-5(3-7(6)10)4-13-8(11)12/h1-3H,4H2,(H3,11,12)
- InChIKey
- LZTCFLDZLBOLDW-UHFFFAOYSA-N
- Compound name
- (3,4-dichlorophenyl)methyl carbamimidothioate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 234.98581 | 145.7 |
[M+Na]+ | 256.96775 | 154.6 |
[M-H]- | 232.97125 | 148.8 |
[M+NH4]+ | 252.01235 | 164.8 |
[M+K]+ | 272.94169 | 148.1 |
[M+H-H2O]+ | 216.97579 | 142.0 |
[M+HCOO]- | 278.97673 | 156.0 |
[M+CH3COO]- | 292.99238 | 191.2 |
[M+Na-2H]- | 254.95320 | 147.0 |
[M]+ | 233.97798 | 147.1 |
[M]- | 233.97908 | 147.1 |