| SpectraBase Compound ID | 88APXYbbzuq |
|---|---|
| InChI | InChI=1S/C17H16O6/c1-20-13-9-6-10-14(21-2)15(13)23-17(19)12-8-5-4-7-11(12)16(18)22-3/h4-10H,1-3H3 |
| InChIKey | OFTGTGHBWRZAPY-UHFFFAOYSA-N |
| Mol Weight | 316.31 g/mol |
| Molecular Formula | C17H16O6 |
| Exact Mass | 316.094688 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JyJNUX8ilSu |
|---|---|
| Name | Phthalic acid, 2,6-dimethoxyphenyl methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.094688229 u |
| Formula | C17H16O6 |
| InChI | InChI=1S/C17H16O6/c1-20-13-9-6-10-14(21-2)15(13)23-17(19)12-8-5-4-7-11(12)16(18)22-3/h4-10H,1-3H3 |
| InChIKey | OFTGTGHBWRZAPY-UHFFFAOYSA-N |
| Molecular Weight | 316.309 g/mol |
| SMILES | C(OC1=C(OC)C=CC=C1OC)(=O)C1=C(C=CC=C1)C(OC)=O |