| SpectraBase Compound ID | GBGExBN5xC4 |
|---|---|
| InChI | InChI=1S/C12H12Cl2O4/c13-5-7-17-11(15)9-1-2-10(4-3-9)12(16)18-8-6-14/h1-4H,5-8H2 |
| InChIKey | DBNYVAWEUHWAAQ-UHFFFAOYSA-N |
| Mol Weight | 291.13 g/mol |
| Molecular Formula | C12H12Cl2O4 |
| Exact Mass | 290.011264 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 | DQbJsQJVa84 |
|---|---|
| Name | Terephthalic acid, di(2-chloroethyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.011264262 u |
| Formula | C12H12Cl2O4 |
| InChI | InChI=1S/C12H12Cl2O4/c13-5-7-17-11(15)9-1-2-10(4-3-9)12(16)18-8-6-14/h1-4H,5-8H2 |
| InChIKey | DBNYVAWEUHWAAQ-UHFFFAOYSA-N |
| SMILES | C(COC(=O)C1=CC=C(C(OCCCl)=O)C=C1)Cl |