| SpectraBase Compound ID | LCgsYgoT84C |
|---|---|
| InChI | InChI=1S/C15H12N2O/c18-15-14-9-5-4-8-13(14)10-16-17(15)11-12-6-2-1-3-7-12/h1-10H,11H2 |
| InChIKey | VNZBEMQOBGYHTK-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C15H12N2O |
| Exact Mass | 236.094963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 64kyU3kDyGs |
|---|---|
| Name | 2-Benzylphthalazin-1(2H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.094963013 u |
| Formula | C15H12N2O |
| InChI | InChI=1S/C15H12N2O/c18-15-14-9-5-4-8-13(14)10-16-17(15)11-12-6-2-1-3-7-12/h1-10H,11H2 |
| InChIKey | VNZBEMQOBGYHTK-UHFFFAOYSA-N |
| Molecular Weight | 236.274 g/mol |
| SMILES | C1(N(N=CC=2C=CC=CC12)CC=1C=CC=CC1)=O |