CID 43348918
2-[5-amino-3-(4-bromophenyl)-1h-pyrazol-1-yl]ethan-1-ol
Structural Information
- Molecular Formula
- C11H12BrN3O
- SMILES
- C1=CC(=CC=C1C2=NN(C(=C2)N)CCO)Br
- InChI
- InChI=1S/C11H12BrN3O/c12-9-3-1-8(2-4-9)10-7-11(13)15(14-10)5-6-16/h1-4,7,16H,5-6,13H2
- InChIKey
- ILSAXBMAGDRDGN-UHFFFAOYSA-N
- Compound name
- 2-[5-amino-3-(4-bromophenyl)pyrazol-1-yl]ethanol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 282.02364 | 154.4 |
[M+Na]+ | 304.00558 | 166.4 |
[M-H]- | 280.00908 | 160.0 |
[M+NH4]+ | 299.05018 | 172.3 |
[M+K]+ | 319.97952 | 153.7 |
[M+H-H2O]+ | 264.01362 | 152.5 |
[M+HCOO]- | 326.01456 | 174.6 |
[M+CH3COO]- | 340.03021 | 195.1 |
[M+Na-2H]- | 301.99103 | 159.3 |
[M]+ | 281.01581 | 171.9 |
[M]- | 281.01691 | 171.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.