CID 66545189
[2-chloro-4-(1h-1,2,4-triazol-1-yl)phenyl]methanol
Structural Information
- Molecular Formula
- C9H8ClN3O
- SMILES
- C1=CC(=C(C=C1N2C=NC=N2)Cl)CO
- InChI
- InChI=1S/C9H8ClN3O/c10-9-3-8(2-1-7(9)4-14)13-6-11-5-12-13/h1-3,5-6,14H,4H2
- InChIKey
- LXOKIKAKZYHCJX-UHFFFAOYSA-N
- Compound name
- [2-chloro-4-(1,2,4-triazol-1-yl)phenyl]methanol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 210.04286 | 141.4 |
[M+Na]+ | 232.02480 | 152.2 |
[M-H]- | 208.02830 | 143.2 |
[M+NH4]+ | 227.06940 | 158.2 |
[M+K]+ | 247.99874 | 147.2 |
[M+H-H2O]+ | 192.03284 | 133.3 |
[M+HCOO]- | 254.03378 | 158.2 |
[M+CH3COO]- | 268.04943 | 154.2 |
[M+Na-2H]- | 230.01025 | 147.0 |
[M]+ | 209.03503 | 143.1 |
[M]- | 209.03613 | 143.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.