| SpectraBase Compound ID | KFnbnBa9mAN |
|---|---|
| InChI | InChI=1S/C23H35ClO4/c1-2-3-4-5-6-7-8-9-10-18-27-22(25)15-16-23(26)28-19-17-20-11-13-21(24)14-12-20/h11-14H,2-10,15-19H2,1H3 |
| InChIKey | CVJMSNDWZFJDDC-UHFFFAOYSA-N |
| Mol Weight | 411.0 g/mol |
| Molecular Formula | C23H35ClO4 |
| Exact Mass | 410.222387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2zfx3KA5voW |
|---|---|
| Name | Succinic acid, 4-chlorophenethyl undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 410.222387303 u |
| Formula | C23H35ClO4 |
| InChI | InChI=1S/C23H35ClO4/c1-2-3-4-5-6-7-8-9-10-18-27-22(25)15-16-23(26)28-19-17-20-11-13-21(24)14-12-20/h11-14H,2-10,15-19H2,1H3 |
| InChIKey | CVJMSNDWZFJDDC-UHFFFAOYSA-N |
| Molecular Weight | 410.982 g/mol |
| SMILES | C(CCC(OCCC1=CC=C(C=C1)Cl)=O)(OCCCCCCCCCCC)=O |