CID 13878
Deisopropylatrazine
Structural Information
- Molecular Formula
- C5H8ClN5
- SMILES
- CCNC1=NC(=NC(=N1)N)Cl
- InChI
- InChI=1S/C5H8ClN5/c1-2-8-5-10-3(6)9-4(7)11-5/h2H2,1H3,(H3,7,8,9,10,11)
- InChIKey
- IVENSCMCQBJAKW-UHFFFAOYSA-N
- Compound name
- 6-chloro-2-N-ethyl-1,3,5-triazine-2,4-diamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 174.05411 | 134.3 |
[M+Na]+ | 196.03605 | 144.3 |
[M-H]- | 172.03955 | 133.8 |
[M+NH4]+ | 191.08065 | 150.9 |
[M+K]+ | 212.00999 | 140.5 |
[M+H-H2O]+ | 156.04409 | 126.8 |
[M+HCOO]- | 218.04503 | 152.9 |
[M+CH3COO]- | 232.06068 | 182.7 |
[M+Na-2H]- | 194.02150 | 142.3 |
[M]+ | 173.04628 | 134.2 |
[M]- | 173.04738 | 134.2 |