| SpectraBase Spectrum ID |
DyHWe5YX5sE |
| Name |
Ethyl-3-ethoxy-3-hydroxy-2-(4-nitrobenzoyl)acrylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
309.084851820 u |
| Formula |
C14H15NO7 |
| InChI |
InChI=1S/C14H15NO7/c1-3-21-13(17)11(14(18)22-4-2)12(16)9-5-7-10(8-6-9)15(19)20/h5-8,17H,3-4H2,1-2H3/b13-11+ |
| InChIKey |
UKSUVCMDZFQKCH-ACCUITESSA-N |
| Molecular Weight |
309.274 g/mol |
| SMILES |
C(\C(=C\(O)OCC)C(=O)OCC)(C=1C=CC(N(=O)=O)=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93983 |
