| SpectraBase Compound ID | Ejadaayx7Ge |
|---|---|
| InChI | InChI=1S/C16H20O5/c1-11(2)12(3)20-15(17)9-10-16(18)21-14-8-6-5-7-13(14)19-4/h5-12H,1-4H3/b10-9+ |
| InChIKey | ZXSHXGYSXHWSNC-MDZDMXLPSA-N |
| Mol Weight | 292.33 g/mol |
| Molecular Formula | C16H20O5 |
| Exact Mass | 292.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5s4qR9GyfoC |
|---|---|
| Name | Fumaric acid, 2-methoxyphenyl 3-methylbut-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.131073739 u |
| Formula | C16H20O5 |
| InChI | InChI=1S/C16H20O5/c1-11(2)12(3)20-15(17)9-10-16(18)21-14-8-6-5-7-13(14)19-4/h5-12H,1-4H3/b10-9+ |
| InChIKey | ZXSHXGYSXHWSNC-MDZDMXLPSA-N |
| SMILES | C(\C=C\C(OC(C(C)C)C)=O)(OC1=C(OC)C=CC=C1)=O |