| SpectraBase Compound ID | J9pHUB8AWhs |
|---|---|
| InChI | InChI=1S/C18H14N2O3/c1-2-23-18(22)16-15(17(21)12-8-4-3-5-9-12)19-13-10-6-7-11-14(13)20-16/h3-11H,2H2,1H3 |
| InChIKey | XUGNXVANDLUSTP-UHFFFAOYSA-N |
| Mol Weight | 306.32 g/mol |
| Molecular Formula | C18H14N2O3 |
| Exact Mass | 306.100442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 74ZIqFHKxh3 |
|---|---|
| Name | 2-Quinoxalinecarboxylic acid, 3-benzoyl-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.100442316 u |
| Formula | C18H14N2O3 |
| InChI | InChI=1S/C18H14N2O3/c1-2-23-18(22)16-15(17(21)12-8-4-3-5-9-12)19-13-10-6-7-11-14(13)20-16/h3-11H,2H2,1H3 |
| InChIKey | XUGNXVANDLUSTP-UHFFFAOYSA-N |
| Molecular Weight | 306.321 g/mol |
| SMILES | C=1(C(=NC=2C(N1)=CC=CC2)C(=O)OCC)C(=O)C1=CC=CC=C1 |