| SpectraBase Compound ID | IVGuyiCJs7i |
|---|---|
| InChI | InChI=1S/C13H8ClFN2O2S/c14-9-3-1-4-10(15)8(9)7-20-13-17-16-12(19-13)11-5-2-6-18-11/h1-6H,7H2 |
| InChIKey | CUTIAYMPUDKJLL-UHFFFAOYSA-N |
| Mol Weight | 310.73 g/mol |
| Molecular Formula | C13H8ClFN2O2S |
| Exact Mass | 309.997905 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 | 1gbDRJMcmXG |
|---|---|
| Name | 2-((2-Chloro-6-fluorobenzyl)sulfanyl)-5-(2-furyl)-1,3,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.997904541 u |
| Formula | C13H8ClFN2O2S |
| InChI | InChI=1S/C13H8ClFN2O2S/c14-9-3-1-4-10(15)8(9)7-20-13-17-16-12(19-13)11-5-2-6-18-11/h1-6H,7H2 |
| InChIKey | CUTIAYMPUDKJLL-UHFFFAOYSA-N |
| Molecular Weight | 310.730 g/mol |
| SMILES | C=1(OC(SCC2=C(F)C=CC=C2Cl)=NN1)C=1OC=CC1 |