| SpectraBase Compound ID | 8zRjRIDwxOF |
|---|---|
| InChI | InChI=1S/C13H16O4/c1-5-6-10-7-11(15-3)13(16-4)12(8-10)17-9(2)14/h5,7-8H,1,6H2,2-4H3 |
| InChIKey | FIODZCWWMCAMSB-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C13H16O4 |
| Exact Mass | 236.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8scAOBsDEUD |
|---|---|
| Name | Benzene, 1-acetoxy-2,3-dimethoxy-5-(2-propenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.104858991 u |
| Formula | C13H16O4 |
| InChI | InChI=1S/C13H16O4/c1-5-6-10-7-11(15-3)13(16-4)12(8-10)17-9(2)14/h5,7-8H,1,6H2,2-4H3 |
| InChIKey | FIODZCWWMCAMSB-UHFFFAOYSA-N |
| Molecular Weight | 236.267 g/mol |
| SMILES | C1(=CC(=C(C(=C1)OC(C)=O)OC)OC)CC=C |