| SpectraBase Compound ID | A53KaEZwo7o |
|---|---|
| InChI | InChI=1S/C13H14O5/c1-3-17-13(15)18-11-7-6-10(5-4-8-14)9-12(11)16-2/h4-9H,3H2,1-2H3/b5-4+ |
| InChIKey | GAYFTEFELCFSRG-SNAWJCMRSA-N |
| Mol Weight | 250.25 g/mol |
| Molecular Formula | C13H14O5 |
| Exact Mass | 250.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7itnaseaiSK |
|---|---|
| Name | 3-(4-Ethoxycarbonyloxy-3-methoxyphenyl)-2-propenal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.084123546 u |
| Formula | C13H14O5 |
| InChI | InChI=1S/C13H14O5/c1-3-17-13(15)18-11-7-6-10(5-4-8-14)9-12(11)16-2/h4-9H,3H2,1-2H3/b5-4+ |
| InChIKey | GAYFTEFELCFSRG-SNAWJCMRSA-N |
| Molecular Weight | 250.250 g/mol |
| SMILES | C(\C=C\C1=CC(OC)=C(C=C1)OC(OCC)=O)=O |