CID 72211811
4-(3-chlorophenyl)-1h-pyrazole hydrochloride
Structural Information
- Molecular Formula
- C9H7ClN2
- SMILES
- C1=CC(=CC(=C1)Cl)C2=CNN=C2
- InChI
- InChI=1S/C9H7ClN2/c10-9-3-1-2-7(4-9)8-5-11-12-6-8/h1-6H,(H,11,12)
- InChIKey
- FCGSNXWYYALGBL-UHFFFAOYSA-N
- Compound name
- 4-(3-chlorophenyl)-1H-pyrazole
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 179.03705 | 134.2 |
[M+Na]+ | 201.01899 | 144.3 |
[M-H]- | 177.02249 | 137.1 |
[M+NH4]+ | 196.06359 | 153.5 |
[M+K]+ | 216.99293 | 138.8 |
[M+H-H2O]+ | 161.02703 | 127.0 |
[M+HCOO]- | 223.02797 | 152.2 |
[M+CH3COO]- | 237.04362 | 147.6 |
[M+Na-2H]- | 199.00444 | 140.6 |
[M]+ | 178.02922 | 133.7 |
[M]- | 178.03032 | 133.7 |
Literature stripe
No literature data available for this compound.