![5-(4-Methylphenyl)-3-[(E)-2-phenylethenyl]-1,2,4-oxadiazole](/api/spectrum/1YqeTIIHTVG/structure.png?h=300&w=458 "5-(4-Methylphenyl)-3-[(E)-2-phenylethenyl]-1,2,4-oxadiazole")
| SpectraBase Compound ID | Brq9YyCSYLi |
|---|---|
| InChI | InChI=1S/C17H14N2O/c1-13-7-10-15(11-8-13)17-18-16(19-20-17)12-9-14-5-3-2-4-6-14/h2-12H,1H3/b12-9+ |
| InChIKey | UXMCMXAFBINIMM-FMIVXFBMSA-N |
| Mol Weight | 262.31 g/mol |
| Molecular Formula | C17H14N2O |
| Exact Mass | 262.110613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1YqeTIIHTVG |
|---|---|
| Name | 5-(4-Methylphenyl)-3-[(E)-2-phenylethenyl]-1,2,4-oxadiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.110613078 u |
| Formula | C17H14N2O |
| InChI | InChI=1S/C17H14N2O/c1-13-7-10-15(11-8-13)17-18-16(19-20-17)12-9-14-5-3-2-4-6-14/h2-12H,1H3/b12-9+ |
| InChIKey | UXMCMXAFBINIMM-FMIVXFBMSA-N |
| Molecular Weight | 262.312 g/mol |
| SMILES | C1(=NC(=NO1)\C=C\C1=CC=CC=C1)C=1C=CC(=CC1)C |