| SpectraBase Compound ID | IyFjd06waRu |
|---|---|
| InChI | InChI=1S/C13H24O4/c1-10(2)6-7-11(3)12(17-9-15-4)8-13(14)16-5/h6,11-12H,7-9H2,1-5H3/t11-,12+/m1/s1 |
| InChIKey | VWDDLAFVCLPGTL-NEPJUHHUSA-N |
| Mol Weight | 244.33 g/mol |
| Molecular Formula | C13H24O4 |
| Exact Mass | 244.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Qj5mg8c9PF |
|---|---|
| Name | (3S,4R)-3-Methoxymethoxy-4,7-dimethyloct-6-enoic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.167459249 u |
| Formula | C13H24O4 |
| InChI | InChI=1S/C13H24O4/c1-10(2)6-7-11(3)12(17-9-15-4)8-13(14)16-5/h6,11-12H,7-9H2,1-5H3/t11-,12+/m1/s1 |
| InChIKey | VWDDLAFVCLPGTL-NEPJUHHUSA-N |
| Molecular Weight | 244.331 g/mol |
| SMILES | C(C(=O)OC)[C@@]([C@@](CC=C(C)C)(C)[H])(OCOC)[H] |