| SpectraBase Compound ID | KjLDq3OdFdT |
|---|---|
| InChI | InChI=1S/C15H12N2OS/c1-3-7-12(8-4-1)11-19-15-17-16-14(18-15)13-9-5-2-6-10-13/h1-10H,11H2 |
| InChIKey | JQQURXNULCDCHO-UHFFFAOYSA-N |
| Mol Weight | 268.33 g/mol |
| Molecular Formula | C15H12N2OS |
| Exact Mass | 268.067034 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 | I7BPiA84Mpw |
|---|---|
| Name | 2-(Benzylthio)-5-phenyl-1,3,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.067034187 u |
| Formula | C15H12N2OS |
| InChI | InChI=1S/C15H12N2OS/c1-3-7-12(8-4-1)11-19-15-17-16-14(18-15)13-9-5-2-6-10-13/h1-10H,11H2 |
| InChIKey | JQQURXNULCDCHO-UHFFFAOYSA-N |
| SMILES | C=1(OC(=NN1)C1=CC=CC=C1)SCC1=CC=CC=C1 |