| SpectraBase Compound ID | CIq72g0TU1U |
|---|---|
| InChI | InChI=1S/C20H37ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)23-19-18-21/h9-10H,2-8,11-19H2,1H3/b10-9+ |
| InChIKey | VEFKNRVOMTXTSC-MDZDMXLPSA-N |
| Mol Weight | 345.0 g/mol |
| Molecular Formula | C20H37ClO2 |
| Exact Mass | 344.248208 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HHjsIHp3Ut0 |
|---|---|
| Name | 2-Chloroethyl (9E)-9-octadecenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.248208129 u |
| Formula | C20H37ClO2 |
| InChI | InChI=1S/C20H37ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)23-19-18-21/h9-10H,2-8,11-19H2,1H3/b10-9+ |
| InChIKey | VEFKNRVOMTXTSC-MDZDMXLPSA-N |
| Molecular Weight | 344.967 g/mol |
| SMILES | CCCCCCCC\C=C\CCCCCCCC(=O)OCCCl |