CID 126839428
6-bromo-3-iodo-2-methoxypyrazolo[1,5-a]pyrimidine
Structural Information
- Molecular Formula
- C7H5BrIN3O
- SMILES
- COC1=NN2C=C(C=NC2=C1I)Br
- InChI
- InChI=1S/C7H5BrIN3O/c1-13-7-5(9)6-10-2-4(8)3-12(6)11-7/h2-3H,1H3
- InChIKey
- PXICRCBTWBIKHI-UHFFFAOYSA-N
- Compound name
- 6-bromo-3-iodo-2-methoxypyrazolo[1,5-a]pyrimidine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 353.87334 | 140.7 |
[M+Na]+ | 375.85528 | 149.8 |
[M-H]- | 351.85878 | 138.8 |
[M+NH4]+ | 370.89988 | 156.8 |
[M+K]+ | 391.82922 | 145.0 |
[M+H-H2O]+ | 335.86332 | 136.6 |
[M+HCOO]- | 397.86426 | 157.3 |
[M+CH3COO]- | 411.87991 | 152.9 |
[M+Na-2H]- | 373.84073 | 139.3 |
[M]+ | 352.86551 | 159.9 |
[M]- | 352.86661 | 159.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.