| SpectraBase Compound ID | ICAFRxZyvfY |
|---|---|
| InChI | InChI=1S/C17H14N2O3/c1-2-4-12(5-3-1)6-9-16-18-17(19-22-16)13-7-8-14-15(10-13)21-11-20-14/h1-5,7-8,10H,6,9,11H2 |
| InChIKey | UVECBODHZDUVSZ-UHFFFAOYSA-N |
| Mol Weight | 294.31 g/mol |
| Molecular Formula | C17H14N2O3 |
| Exact Mass | 294.100442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68iJQxQU85z |
|---|---|
| Name | 1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-(2-phenylethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.100442316 u |
| Formula | C17H14N2O3 |
| InChI | InChI=1S/C17H14N2O3/c1-2-4-12(5-3-1)6-9-16-18-17(19-22-16)13-7-8-14-15(10-13)21-11-20-14/h1-5,7-8,10H,6,9,11H2 |
| InChIKey | UVECBODHZDUVSZ-UHFFFAOYSA-N |
| Molecular Weight | 294.310 g/mol |
| SMILES | C1=C2C(=CC=C1C1=NOC(=N1)CCC1=CC=CC=C1)OCO2 |