| SpectraBase Compound ID | 4P8vcAWSzZj |
|---|---|
| InChI | InChI=1S/C17H14N2O2/c1-11-15(17(21)12-7-3-2-4-8-12)16(19-18-11)13-9-5-6-10-14(13)20/h2-10,20H,1H3,(H,18,19) |
| InChIKey | NDSMPHOPZJQYLL-UHFFFAOYSA-N |
| Mol Weight | 278.31 g/mol |
| Molecular Formula | C17H14N2O2 |
| Exact Mass | 278.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5u863WwaB2U |
|---|---|
| Name | 5-(o-Hydroxyphenyl)-3-methylpyrazol-4-yl phenyl ketone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.105527697 u |
| Formula | C17H14N2O2 |
| InChI | InChI=1S/C17H14N2O2/c1-11-15(17(21)12-7-3-2-4-8-12)16(19-18-11)13-9-5-6-10-14(13)20/h2-10,20H,1H3,(H,18,19) |
| InChIKey | NDSMPHOPZJQYLL-UHFFFAOYSA-N |
| Molecular Weight | 278.311 g/mol |
| SMILES | OC1=C(C2=C(C(=NN2)C)C(=O)C=2C=CC=CC2)C=CC=C1 |