| SpectraBase Compound ID | 8fpnRJEiOxe |
|---|---|
| InChI | InChI=1S/C9H7BrN2O/c10-7-3-1-6(2-4-7)8-5-9(13)12-11-8/h1-5H,(H2,11,12,13) |
| InChIKey | NIEUMLZXCZNYEF-UHFFFAOYSA-N |
| Mol Weight | 239.07 g/mol |
| Molecular Formula | C9H7BrN2O |
| Exact Mass | 237.974176 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | dsB0OxFMN4 |
|---|---|
| Name | Pyrazol-5-ol, 3-(4-bromophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.974175852 u |
| Formula | C9H7BrN2O |
| InChI | InChI=1S/C9H7BrN2O/c10-7-3-1-6(2-4-7)8-5-9(13)12-11-8/h1-5H,(H2,11,12,13) |
| InChIKey | NIEUMLZXCZNYEF-UHFFFAOYSA-N |
| Molecular Weight | 239.072 g/mol |
| SMILES | C=1C(=NNC1O)C=1C=CC(=CC1)Br |