| SpectraBase Compound ID | IhQbY6HI07U |
|---|---|
| InChI | InChI=1S/C13H14N2O3/c1-2-18-12(16)8-7-11-13(17)15-10-6-4-3-5-9(10)14-11/h3-6H,2,7-8H2,1H3,(H,15,17) |
| InChIKey | HDMCYNMZRABKGL-UHFFFAOYSA-N |
| Mol Weight | 246.27 g/mol |
| Molecular Formula | C13H14N2O3 |
| Exact Mass | 246.100442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 41ItMUbRWFo |
|---|---|
| Name | 3-(2-Ethoxycarbonylethyl)-2(1H)-quinoxalinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.100442316 u |
| Formula | C13H14N2O3 |
| InChI | InChI=1S/C13H14N2O3/c1-2-18-12(16)8-7-11-13(17)15-10-6-4-3-5-9(10)14-11/h3-6H,2,7-8H2,1H3,(H,15,17) |
| InChIKey | HDMCYNMZRABKGL-UHFFFAOYSA-N |
| Molecular Weight | 246.266 g/mol |
| SMILES | C12=C(NC(C(=N2)CCC(OCC)=O)=O)C=CC=C1 |