| SpectraBase Compound ID | Al7wipN1OGM |
|---|---|
| InChI | InChI=1S/C20H29ClO4/c1-2-3-4-5-6-7-8-9-15-24-19(22)17-10-12-18(13-11-17)20(23)25-16-14-21/h10-13H,2-9,14-16H2,1H3 |
| InChIKey | GZALEZZVALQAOH-UHFFFAOYSA-N |
| Mol Weight | 368.9 g/mol |
| Molecular Formula | C20H29ClO4 |
| Exact Mass | 368.175437 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KofLw3TCcyg |
|---|---|
| Name | Terephthalic acid, 2-chloroethyl decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 368.175437110 u |
| Formula | C20H29ClO4 |
| InChI | InChI=1S/C20H29ClO4/c1-2-3-4-5-6-7-8-9-15-24-19(22)17-10-12-18(13-11-17)20(23)25-16-14-21/h10-13H,2-9,14-16H2,1H3 |
| InChIKey | GZALEZZVALQAOH-UHFFFAOYSA-N |
| Molecular Weight | 368.901 g/mol |
| SMILES | CCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCl |