![1,2,4-Oxadiazole-3-carboxamide, N-[2-(acetyloxy)propyl]-5-methyl-](/api/spectrum/4BDqnyXmPol/structure.png?h=300&w=458 "1,2,4-Oxadiazole-3-carboxamide, N-[2-(acetyloxy)propyl]-5-methyl-")
| SpectraBase Compound ID | 50zIzLJIvUL |
|---|---|
| InChI | InChI=1S/C9H13N3O4/c1-5(15-7(3)13)4-10-9(14)8-11-6(2)16-12-8/h5H,4H2,1-3H3,(H,10,14) |
| InChIKey | JHXFWBHRBDYRIK-UHFFFAOYSA-N |
| Mol Weight | 227.22 g/mol |
| Molecular Formula | C9H13N3O4 |
| Exact Mass | 227.090606 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4BDqnyXmPol |
|---|---|
| Name | 1,2,4-Oxadiazole-3-carboxamide, N-[2-(acetyloxy)propyl]-5-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.090605907 u |
| Formula | C9H13N3O4 |
| InChI | InChI=1S/C9H13N3O4/c1-5(15-7(3)13)4-10-9(14)8-11-6(2)16-12-8/h5H,4H2,1-3H3,(H,10,14) |
| InChIKey | JHXFWBHRBDYRIK-UHFFFAOYSA-N |
| Molecular Weight | 227.220 g/mol |
| SMILES | C=1(N=C(C)ON1)C(NCC(OC(=O)C)C)=O |