| SpectraBase Compound ID | F3hOvkKGfVy |
|---|---|
| InChI | InChI=1S/C15H11FN2O2S/c16-10-4-6-11(7-5-10)18-14(19)9-12(15(18)20)21-13-3-1-2-8-17-13/h1-8,12H,9H2 |
| InChIKey | HGLJFHIZYFFNEK-UHFFFAOYSA-N |
| Mol Weight | 302.32 g/mol |
| Molecular Formula | C15H11FN2O2S |
| Exact Mass | 302.052527 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 | BNioGLD8Xu3 |
|---|---|
| Name | 1-(4-Fluorophenyl)-3-(2-pyridinylsulfanyl)-2,5-pyrrolidinedione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.052526937 u |
| Formula | C15H11FN2O2S |
| InChI | InChI=1S/C15H11FN2O2S/c16-10-4-6-11(7-5-10)18-14(19)9-12(15(18)20)21-13-3-1-2-8-17-13/h1-8,12H,9H2 |
| InChIKey | HGLJFHIZYFFNEK-UHFFFAOYSA-N |
| Molecular Weight | 302.323 g/mol |
| SMILES | C1=CC=NC(SC2C(N(C(C2)=O)C=2C=CC(=CC2)F)=O)=C1 |