| SpectraBase Compound ID | Cgm0hwqiTDc |
|---|---|
| InChI | InChI=1S/C18H30Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-14-23-17(21)12-13-18(22)24-15-16(19)20/h12-13,16H,2-11,14-15H2,1H3/b13-12+ |
| InChIKey | IDWSWXWSQPMUQF-OUKQBFOZSA-N |
| Mol Weight | 381.34 g/mol |
| Molecular Formula | C18H30Cl2O4 |
| Exact Mass | 380.152115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1KWAalUK6lv |
|---|---|
| Name | Fumaric acid, 2,2-dichloroethyl dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 380.152114842 u |
| Formula | C18H30Cl2O4 |
| InChI | InChI=1S/C18H30Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-14-23-17(21)12-13-18(22)24-15-16(19)20/h12-13,16H,2-11,14-15H2,1H3/b13-12+ |
| InChIKey | IDWSWXWSQPMUQF-OUKQBFOZSA-N |
| Molecular Weight | 381.340 g/mol |
| SMILES | C(OCC(Cl)Cl)(\C=C\C(OCCCCCCCCCCCC)=O)=O |