| SpectraBase Compound ID | BdX9TMfI31R |
|---|---|
| InChI | InChI=1S/C15H20O6/c1-9(20-10(2)16)15(21-11(3)17)12-6-7-13(18-4)14(8-12)19-5/h6-9,15H,1-5H3 |
| InChIKey | NNZHPRGCBQMVTG-UHFFFAOYSA-N |
| Mol Weight | 296.32 g/mol |
| Molecular Formula | C15H20O6 |
| Exact Mass | 296.125988 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5chTUvZNV5T |
|---|---|
| Name | 1,2-Propanediol, 1-(3,4-dimethoxyphenyl)-, diacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.125988358 u |
| Formula | C15H20O6 |
| InChI | InChI=1S/C15H20O6/c1-9(20-10(2)16)15(21-11(3)17)12-6-7-13(18-4)14(8-12)19-5/h6-9,15H,1-5H3 |
| InChIKey | NNZHPRGCBQMVTG-UHFFFAOYSA-N |
| SMILES | C=1(C(C(OC(=O)C)C)OC(=O)C)C=C(OC)C(=CC1)OC |