| SpectraBase Compound ID | 3aHIDpyJDbg |
|---|---|
| InChI | InChI=1S/C21H13NO3/c23-19(14-8-2-1-3-9-14)17-12-6-7-13-18(17)22-20(24)15-10-4-5-11-16(15)21(22)25/h1-13H |
| InChIKey | QDPCKUWFILIUPE-UHFFFAOYSA-N |
| Mol Weight | 327.34 g/mol |
| Molecular Formula | C21H13NO3 |
| Exact Mass | 327.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3ljk92vwBkO |
|---|---|
| Name | 2-(2-Benzoylphenyl)isoindole-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.089543280 u |
| Formula | C21H13NO3 |
| InChI | InChI=1S/C21H13NO3/c23-19(14-8-2-1-3-9-14)17-12-6-7-13-18(17)22-20(24)15-10-4-5-11-16(15)21(22)25/h1-13H |
| InChIKey | QDPCKUWFILIUPE-UHFFFAOYSA-N |
| Molecular Weight | 327.339 g/mol |
| SMILES | C1(N(C(C2=CC=CC=C12)=O)C=1C(C(=O)C2=CC=CC=C2)=CC=CC1)=O |