| SpectraBase Compound ID | IrNXQYu2ASx |
|---|---|
| InChI | InChI=1S/C14H16O5/c1-4-19-14(16)6-5-13(15)10-7-11(17-2)9-12(8-10)18-3/h5-9H,4H2,1-3H3/b6-5- |
| InChIKey | CWQRGDINIZFDLV-WAYWQWQTSA-N |
| Mol Weight | 264.28 g/mol |
| Molecular Formula | C14H16O5 |
| Exact Mass | 264.099774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BJIijdijtf |
|---|---|
| Name | (Z)-Ethyl 4-(3,5-dimethoxyphenyl)-4-oxobut-2-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.099773610 u |
| Formula | C14H16O5 |
| InChI | InChI=1S/C14H16O5/c1-4-19-14(16)6-5-13(15)10-7-11(17-2)9-12(8-10)18-3/h5-9H,4H2,1-3H3/b6-5- |
| InChIKey | CWQRGDINIZFDLV-WAYWQWQTSA-N |
| Molecular Weight | 264.277 g/mol |
| SMILES | C=1C(=CC(C(=O)\C=C/C(OCC)=O)=CC1OC)OC |