| SpectraBase Compound ID | EMpKi4QP8ei |
|---|---|
| InChI | InChI=1S/C20H29ClO5/c1-24-18-10-8-17(9-11-18)16-26-20(23)13-12-19(22)25-15-7-5-3-2-4-6-14-21/h8-11H,2-7,12-16H2,1H3 |
| InChIKey | VFRPABTUMGHZMC-UHFFFAOYSA-N |
| Mol Weight | 384.9 g/mol |
| Molecular Formula | C20H29ClO5 |
| Exact Mass | 384.170352 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J3AkartuBDk |
|---|---|
| Name | Succinic acid, 8-chlorooctyl 4-methoxybenzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 384.170351729 u |
| Formula | C20H29ClO5 |
| InChI | InChI=1S/C20H29ClO5/c1-24-18-10-8-17(9-11-18)16-26-20(23)13-12-19(22)25-15-7-5-3-2-4-6-14-21/h8-11H,2-7,12-16H2,1H3 |
| InChIKey | VFRPABTUMGHZMC-UHFFFAOYSA-N |
| Molecular Weight | 384.900 g/mol |
| SMILES | C(CC(OCCCCCCCCCl)=O)C(OCC1=CC=C(C=C1)OC)=O |