| SpectraBase Compound ID | 4TABsl3Qv6k |
|---|---|
| InChI | InChI=1S/C17H29ClO4/c1-15(2)11-14-22-17(20)10-9-16(19)21-13-8-6-4-3-5-7-12-18/h1,3-14H2,2H3 |
| InChIKey | FCOVUAUGPFVYFC-UHFFFAOYSA-N |
| Mol Weight | 332.87 g/mol |
| Molecular Formula | C17H29ClO4 |
| Exact Mass | 332.175437 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LLonLl3X5DZ |
|---|---|
| Name | Succinic acid, 8-chlorooctyl 3-methylbut-3-en-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.175437110 u |
| Formula | C17H29ClO4 |
| InChI | InChI=1S/C17H29ClO4/c1-15(2)11-14-22-17(20)10-9-16(19)21-13-8-6-4-3-5-7-12-18/h1,3-14H2,2H3 |
| InChIKey | FCOVUAUGPFVYFC-UHFFFAOYSA-N |
| Molecular Weight | 332.868 g/mol |
| SMILES | C(CC(OCCCCCCCCCl)=O)C(OCCC(C)=C)=O |