| SpectraBase Compound ID | G2HXExc06UO |
|---|---|
| InChI | InChI=1S/C18H31ClO4/c1-2-3-4-10-15-22-17(20)12-13-18(21)23-16-11-8-6-5-7-9-14-19/h3-4H,2,5-16H2,1H3/b4-3+ |
| InChIKey | GVZXVMFDMRRAML-ONEGZZNKSA-N |
| Mol Weight | 346.9 g/mol |
| Molecular Formula | C18H31ClO4 |
| Exact Mass | 346.191087 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EAOfnepF1E |
|---|---|
| Name | Succinic acid, 8-chlorooctyl trans-hex-3-en-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.191087174 u |
| Formula | C18H31ClO4 |
| InChI | InChI=1S/C18H31ClO4/c1-2-3-4-10-15-22-17(20)12-13-18(21)23-16-11-8-6-5-7-9-14-19/h3-4H,2,5-16H2,1H3/b4-3+ |
| InChIKey | GVZXVMFDMRRAML-ONEGZZNKSA-N |
| Molecular Weight | 346.895 g/mol |
| SMILES | C(CC(OCCCCCCCCCl)=O)C(OCC\C=C\CC)=O |