| SpectraBase Compound ID | 6xDKoCHjJse |
|---|---|
| InChI | InChI=1S/C16H14N2O/c1-19-14-9-5-8-13(10-14)16-11-15(17-18-16)12-6-3-2-4-7-12/h2-11H,1H3,(H,17,18) |
| InChIKey | OWZOIEXBSDHJJW-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C16H14N2O |
| Exact Mass | 250.110613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JSL9uNAAkPY |
|---|---|
| Name | 3-(3-Methoxyphenyl)-5-phenyl-1H-pyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.110613078 u |
| Formula | C16H14N2O |
| InChI | InChI=1S/C16H14N2O/c1-19-14-9-5-8-13(10-14)16-11-15(17-18-16)12-6-3-2-4-7-12/h2-11H,1H3,(H,17,18) |
| InChIKey | OWZOIEXBSDHJJW-UHFFFAOYSA-N |
| Molecular Weight | 250.301 g/mol |
| SMILES | C=1(NN=C(C1)C1=CC(OC)=CC=C1)C1=CC=CC=C1 |