CID 61732723
1251118-58-7
Structural Information
- Molecular Formula
- C8H14BrN3
- SMILES
- CC1=NN(C(=C1Br)N)C(C)(C)C
- InChI
- InChI=1S/C8H14BrN3/c1-5-6(9)7(10)12(11-5)8(2,3)4/h10H2,1-4H3
- InChIKey
- MWEVZBZPEFPREU-UHFFFAOYSA-N
- Compound name
- 4-bromo-2-tert-butyl-5-methylpyrazol-3-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 232.04439 | 145.9 |
[M+Na]+ | 254.02633 | 159.3 |
[M-H]- | 230.02983 | 150.2 |
[M+NH4]+ | 249.07093 | 167.2 |
[M+K]+ | 270.00027 | 148.1 |
[M+H-H2O]+ | 214.03437 | 145.3 |
[M+HCOO]- | 276.03531 | 165.4 |
[M+CH3COO]- | 290.05096 | 191.0 |
[M+Na-2H]- | 252.01178 | 151.1 |
[M]+ | 231.03656 | 164.4 |
[M]- | 231.03766 | 164.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.