| SpectraBase Compound ID | CP7aoipxtCm |
|---|---|
| InChI | InChI=1S/C20H38O5/c1-17(13-9-8-12-16-20(24-4)25-5)18(21)14-10-6-7-11-15-19(22-2)23-3/h19-20H,1,6-16H2,2-5H3 |
| InChIKey | GZXASISGFCHVAW-UHFFFAOYSA-N |
| Mol Weight | 358.5 g/mol |
| Molecular Formula | C20H38O5 |
| Exact Mass | 358.271924 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AIp57AjdGgH |
|---|---|
| Name | 2-(6,6-Dimethoxyhexyl)-10,10-dimethoxydec-1-en-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 358.271924319 u |
| Formula | C20H38O5 |
| InChI | InChI=1S/C20H38O5/c1-17(13-9-8-12-16-20(24-4)25-5)18(21)14-10-6-7-11-15-19(22-2)23-3/h19-20H,1,6-16H2,2-5H3 |
| InChIKey | GZXASISGFCHVAW-UHFFFAOYSA-N |
| Molecular Weight | 358.519 g/mol |
| SMILES | C=C(C(CCCCCCC(OC)OC)=O)CCCCCC(OC)OC |