![Methyl (E)-3-[2-(4-nitrophenyl)ethoxy]acrylate](/api/spectrum/Cce36GwJCaJ/structure.png?h=300&w=458 "Methyl (E)-3-[2-(4-nitrophenyl)ethoxy]acrylate")
| SpectraBase Compound ID | CIUblQPjJFB |
|---|---|
| InChI | InChI=1S/C12H13NO5/c1-17-12(14)7-9-18-8-6-10-2-4-11(5-3-10)13(15)16/h2-5,7,9H,6,8H2,1H3/b9-7+ |
| InChIKey | PEUPMGDOEKJKTJ-VQHVLOKHSA-N |
| Mol Weight | 251.24 g/mol |
| Molecular Formula | C12H13NO5 |
| Exact Mass | 251.079373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cce36GwJCaJ |
|---|---|
| Name | Methyl (E)-3-[2-(4-nitrophenyl)ethoxy]acrylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.079372518 u |
| Formula | C12H13NO5 |
| InChI | InChI=1S/C12H13NO5/c1-17-12(14)7-9-18-8-6-10-2-4-11(5-3-10)13(15)16/h2-5,7,9H,6,8H2,1H3/b9-7+ |
| InChIKey | PEUPMGDOEKJKTJ-VQHVLOKHSA-N |
| Molecular Weight | 251.238 g/mol |
| SMILES | C1(N(=O)=O)=CC=C(C=C1)CCO\C=C\C(=O)OC |