| SpectraBase Compound ID | EbmPPuuC4Ac |
|---|---|
| InChI | InChI=1S/C16H30O5/c1-18-15(19-2)11-7-5-6-9-14(13-17)10-8-12-16(20-3)21-4/h9,13,15-16H,5-8,10-12H2,1-4H3/b14-9+ |
| InChIKey | CJZJSKHNLZUASK-NTEUORMPSA-N |
| Mol Weight | 302.41 g/mol |
| Molecular Formula | C16H30O5 |
| Exact Mass | 302.209324 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CF2mLIUTi2u |
|---|---|
| Name | (4',4'-Dimethoxybutyl)-8,8-dimethoxyoct-2(E)-enal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.209324061 u |
| Formula | C16H30O5 |
| InChI | InChI=1S/C16H30O5/c1-18-15(19-2)11-7-5-6-9-14(13-17)10-8-12-16(20-3)21-4/h9,13,15-16H,5-8,10-12H2,1-4H3/b14-9+ |
| InChIKey | CJZJSKHNLZUASK-NTEUORMPSA-N |
| SMILES | C(\C=C\(C=O)CCCC(OC)OC)CCCC(OC)OC |