| SpectraBase Compound ID | 9qPP2AmtGQv |
|---|---|
| InChI | InChI=1S/C12H12O4/c1-8(12(13)14-2)5-9-3-4-10-11(6-9)16-7-15-10/h3-6H,7H2,1-2H3/b8-5+ |
| InChIKey | ONRIBRPCDSNRTI-VMPITWQZSA-N |
| Mol Weight | 220.22 g/mol |
| Molecular Formula | C12H12O4 |
| Exact Mass | 220.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GduoieK0Tfl |
|---|---|
| Name | Methyl (3,4-methylenedioxy)-.alpha.-methylcinnamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.073558862 u |
| Formula | C12H12O4 |
| InChI | InChI=1S/C12H12O4/c1-8(12(13)14-2)5-9-3-4-10-11(6-9)16-7-15-10/h3-6H,7H2,1-2H3/b8-5+ |
| InChIKey | ONRIBRPCDSNRTI-VMPITWQZSA-N |
| Molecular Weight | 220.224 g/mol |
| SMILES | C(\C(=C\C1=CC2=C(C=C1)OCO2)C)(=O)OC |