CID 61036420
4-(4-bromo-1h-pyrazol-1-yl)butan-1-amine
Structural Information
- Molecular Formula
- C7H12BrN3
- SMILES
- C1=C(C=NN1CCCCN)Br
- InChI
- InChI=1S/C7H12BrN3/c8-7-5-10-11(6-7)4-2-1-3-9/h5-6H,1-4,9H2
- InChIKey
- KUYDUMJRJZQDSS-UHFFFAOYSA-N
- Compound name
- 4-(4-bromopyrazol-1-yl)butan-1-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 218.02873 | 139.7 |
[M+Na]+ | 240.01067 | 151.3 |
[M-H]- | 216.01417 | 143.0 |
[M+NH4]+ | 235.05527 | 160.7 |
[M+K]+ | 255.98461 | 140.2 |
[M+H-H2O]+ | 200.01871 | 138.1 |
[M+HCOO]- | 262.01965 | 161.0 |
[M+CH3COO]- | 276.03530 | 186.3 |
[M+Na-2H]- | 237.99612 | 146.3 |
[M]+ | 217.02090 | 157.8 |
[M]- | 217.02200 | 157.8 |
Literature stripe
No literature data available for this compound.
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No patent data available for this compound.