| SpectraBase Compound ID | 9IYIOlIrZZz |
|---|---|
| InChI | InChI=1S/C17H13NO2/c19-16-10-15(18-11-12-6-2-1-3-7-12)17(20)14-9-5-4-8-13(14)16/h1-10,18H,11H2 |
| InChIKey | DCPOAJXJBIMQSU-UHFFFAOYSA-N |
| Mol Weight | 263.3 g/mol |
| Molecular Formula | C17H13NO2 |
| Exact Mass | 263.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5kwddJWXcSi |
|---|---|
| Name | 2-(Benzylamino)naphthalene-1,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.094628661 u |
| Formula | C17H13NO2 |
| InChI | InChI=1S/C17H13NO2/c19-16-10-15(18-11-12-6-2-1-3-7-12)17(20)14-9-5-4-8-13(14)16/h1-10,18H,11H2 |
| InChIKey | DCPOAJXJBIMQSU-UHFFFAOYSA-N |
| Molecular Weight | 263.296 g/mol |
| SMILES | C1(C2=C(C=CC=C2)C(C(=C1)NCC1=CC=CC=C1)=O)=O |