| SpectraBase Compound ID | 5lM8nNeXTzJ |
|---|---|
| InChI | InChI=1S/C18H18O7/c1-21-13-3-7-15(8-4-13)24-17(19)11-23-12-18(20)25-16-9-5-14(22-2)6-10-16/h3-10H,11-12H2,1-2H3 |
| InChIKey | FEXZECRQSUSOAE-UHFFFAOYSA-N |
| Mol Weight | 346.34 g/mol |
| Molecular Formula | C18H18O7 |
| Exact Mass | 346.105253 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Hgav2UFRZd |
|---|---|
| Name | Diglycolic acid, di(4-methoxyphenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.105252913 u |
| Formula | C18H18O7 |
| InChI | InChI=1S/C18H18O7/c1-21-13-3-7-15(8-4-13)24-17(19)11-23-12-18(20)25-16-9-5-14(22-2)6-10-16/h3-10H,11-12H2,1-2H3 |
| InChIKey | FEXZECRQSUSOAE-UHFFFAOYSA-N |
| Molecular Weight | 346.335 g/mol |
| SMILES | C(COCC(=O)OC1=CC=C(OC)C=C1)(=O)OC1=CC=C(OC)C=C1 |