| SpectraBase Compound ID | wN3UbDwVQW |
|---|---|
| InChI | InChI=1S/C18H22O6/c19-17(23-11-15-3-1-9-21-15)13-5-7-14(8-6-13)18(20)24-12-16-4-2-10-22-16/h5-8,15-16H,1-4,9-12H2 |
| InChIKey | XQETYBGVWACPLZ-UHFFFAOYSA-N |
| Mol Weight | 334.37 g/mol |
| Molecular Formula | C18H22O6 |
| Exact Mass | 334.141638 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 | 9Tcw9Iy52Ub |
|---|---|
| Name | Terephthalic acid, di(2-tetrahydrofurylmethyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.141638422 u |
| Formula | C18H22O6 |
| InChI | InChI=1S/C18H22O6/c19-17(23-11-15-3-1-9-21-15)13-5-7-14(8-6-13)18(20)24-12-16-4-2-10-22-16/h5-8,15-16H,1-4,9-12H2 |
| InChIKey | XQETYBGVWACPLZ-UHFFFAOYSA-N |
| Molecular Weight | 334.368 g/mol |
| SMILES | C1COC(COC(=O)C2=CC=C(C=C2)C(=O)OCC2OCCC2)C1 |