| SpectraBase Compound ID | DkvAgITVM3e |
|---|---|
| InChI | InChI=1S/C15H18O7/c1-18-11-8-13(20-3)12(19-2)7-9(11)6-10(14(16)21-4)15(17)22-5/h6-8H,1-5H3 |
| InChIKey | DZVSOZXPPCJUEZ-UHFFFAOYSA-N |
| Mol Weight | 310.3 g/mol |
| Molecular Formula | C15H18O7 |
| Exact Mass | 310.105253 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5NPHmTwp77P |
|---|---|
| Name | (2,4,5-Trimethoxybenzylidene)malonic acid, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.105252913 u |
| Formula | C15H18O7 |
| InChI | InChI=1S/C15H18O7/c1-18-11-8-13(20-3)12(19-2)7-9(11)6-10(14(16)21-4)15(17)22-5/h6-8H,1-5H3 |
| InChIKey | DZVSOZXPPCJUEZ-UHFFFAOYSA-N |
| SMILES | C1=C(C(=CC(=C1OC)OC)C=C(C(OC)=O)C(OC)=O)OC |