![1-[4-(2-Fluorophenyl)piperazin-1-yl]-2-phenylethane-1,2-dione](/api/spectrum/A6MoIAuoU1X/structure.png?h=300&w=458 "1-[4-(2-Fluorophenyl)piperazin-1-yl]-2-phenylethane-1,2-dione")
| SpectraBase Compound ID | HTDkjL4d1Ax |
|---|---|
| InChI | InChI=1S/C18H17FN2O2/c19-15-8-4-5-9-16(15)20-10-12-21(13-11-20)18(23)17(22)14-6-2-1-3-7-14/h1-9H,10-13H2 |
| InChIKey | LVXBVYLBNOLVRN-UHFFFAOYSA-N |
| Mol Weight | 312.34 g/mol |
| Molecular Formula | C18H17FN2O2 |
| Exact Mass | 312.127406 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A6MoIAuoU1X |
|---|---|
| Name | 1-[4-(2-Fluorophenyl)piperazin-1-yl]-2-phenylethane-1,2-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.127405956 u |
| Formula | C18H17FN2O2 |
| InChI | InChI=1S/C18H17FN2O2/c19-15-8-4-5-9-16(15)20-10-12-21(13-11-20)18(23)17(22)14-6-2-1-3-7-14/h1-9H,10-13H2 |
| InChIKey | LVXBVYLBNOLVRN-UHFFFAOYSA-N |
| Molecular Weight | 312.344 g/mol |
| SMILES | C(C(=O)C1=CC=CC=C1)(=O)N1CCN(CC1)C1=C(C=CC=C1)F |