![4-[3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoic acid](/api/spectrum/8ICS74NX3Co/structure.png?h=300&w=458 "4-[3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoic acid")
| SpectraBase Compound ID | GWRmMM6yQCY |
|---|---|
| InChI | InChI=1S/C13H14N2O4/c1-18-10-7-5-9(6-8-10)13-14-11(19-15-13)3-2-4-12(16)17/h5-8H,2-4H2,1H3,(H,16,17) |
| InChIKey | PUOYKXUDPRGQQQ-UHFFFAOYSA-N |
| Mol Weight | 262.26 g/mol |
| Molecular Formula | C13H14N2O4 |
| Exact Mass | 262.095357 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ICS74NX3Co |
|---|---|
| Name | 4-[3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.095356935 u |
| Formula | C13H14N2O4 |
| InChI | InChI=1S/C13H14N2O4/c1-18-10-7-5-9(6-8-10)13-14-11(19-15-13)3-2-4-12(16)17/h5-8H,2-4H2,1H3,(H,16,17) |
| InChIKey | PUOYKXUDPRGQQQ-UHFFFAOYSA-N |
| SMILES | OC(CCCC1=NC(=NO1)C1=CC=C(C=C1)OC)=O |