![2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 1-benzofuran-2-carboxylate](/api/spectrum/AUeIohTfSkK/structure.png?h=300&w=458 "2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 1-benzofuran-2-carboxylate")
| SpectraBase Compound ID | 3kM662kP4bj |
|---|---|
| InChI | InChI=1S/C15H12N2O5/c1-9-6-13(17-22-9)16-14(18)8-20-15(19)12-7-10-4-2-3-5-11(10)21-12/h2-7H,8H2,1H3,(H,16,17,18) |
| InChIKey | NDSMDCUJKMERMO-UHFFFAOYSA-N |
| Mol Weight | 300.27 g/mol |
| Molecular Formula | C15H12N2O5 |
| Exact Mass | 300.074621 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AUeIohTfSkK |
|---|---|
| Name | 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 1-benzofuran-2-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.074621489 u |
| Formula | C15H12N2O5 |
| InChI | InChI=1S/C15H12N2O5/c1-9-6-13(17-22-9)16-14(18)8-20-15(19)12-7-10-4-2-3-5-11(10)21-12/h2-7H,8H2,1H3,(H,16,17,18) |
| InChIKey | NDSMDCUJKMERMO-UHFFFAOYSA-N |
| SMILES | N(C1=NOC(=C1)C)C(COC(C=1OC=2C=CC=CC2C1)=O)=O |