CID 115038044
5-bromo-1-cyclopropyl-1h-pyrazole-4-carboxylic acid
Structural Information
- Molecular Formula
- C7H7BrN2O2
- SMILES
- C1CC1N2C(=C(C=N2)C(=O)O)Br
- InChI
- InChI=1S/C7H7BrN2O2/c8-6-5(7(11)12)3-9-10(6)4-1-2-4/h3-4H,1-2H2,(H,11,12)
- InChIKey
- IIABBBCOMAPKLR-UHFFFAOYSA-N
- Compound name
- 5-bromo-1-cyclopropylpyrazole-4-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 230.97637 | 144.0 |
[M+Na]+ | 252.95831 | 158.6 |
[M-H]- | 228.96181 | 150.9 |
[M+NH4]+ | 248.00291 | 159.9 |
[M+K]+ | 268.93225 | 146.5 |
[M+H-H2O]+ | 212.96635 | 143.1 |
[M+HCOO]- | 274.96729 | 163.7 |
[M+CH3COO]- | 288.98294 | 186.6 |
[M+Na-2H]- | 250.94376 | 149.0 |
[M]+ | 229.96854 | 164.1 |
[M]- | 229.96964 | 164.1 |
Literature stripe
No literature data available for this compound.
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No patent data available for this compound.