| SpectraBase Compound ID | 6qPG6rZz4UV |
|---|---|
| InChI | InChI=1S/C11H12O4/c1-7(15-8(2)12)9-3-4-10-11(5-9)14-6-13-10/h3-5,7H,6H2,1-2H3 |
| InChIKey | YEARKRYUZWGVSA-UHFFFAOYSA-N |
| Mol Weight | 208.21 g/mol |
| Molecular Formula | C11H12O4 |
| Exact Mass | 208.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FYwdphQjdhm |
|---|---|
| Name | 1-(3,4-Methylenedioxyphenyl)ethane-1-ol, acetyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.073558862 u |
| Formula | C11H12O4 |
| InChI | InChI=1S/C11H12O4/c1-7(15-8(2)12)9-3-4-10-11(5-9)14-6-13-10/h3-5,7H,6H2,1-2H3 |
| InChIKey | YEARKRYUZWGVSA-UHFFFAOYSA-N |
| Molecular Weight | 208.213 g/mol |
| SMILES | C(OC(C)=O)(C1=CC2=C(C=C1)OCO2)C |