| SpectraBase Compound ID | 2mPWq683yXy |
|---|---|
| InChI | InChI=1S/C16H24Cl2O4/c1-12(2)5-4-6-13(3)9-10-21-15(19)7-8-16(20)22-11-14(17)18/h5,9,14H,4,6-8,10-11H2,1-3H3/b13-9- |
| InChIKey | OLLMSDFYNCTPLD-LCYFTJDESA-N |
| Mol Weight | 351.27 g/mol |
| Molecular Formula | C16H24Cl2O4 |
| Exact Mass | 350.105165 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9TSoHLYKMZP |
|---|---|
| Name | Succinic acid, 2,2-dichloroethyl neryl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.105164649 u |
| Formula | C16H24Cl2O4 |
| InChI | InChI=1S/C16H24Cl2O4/c1-12(2)5-4-6-13(3)9-10-21-15(19)7-8-16(20)22-11-14(17)18/h5,9,14H,4,6-8,10-11H2,1-3H3/b13-9- |
| InChIKey | OLLMSDFYNCTPLD-LCYFTJDESA-N |
| Molecular Weight | 351.270 g/mol |
| SMILES | C(CC(OCC(Cl)Cl)=O)C(OC\C=C/(CCC=C(C)C)C)=O |