| SpectraBase Compound ID | 6uKtvnntqlY |
|---|---|
| InChI | InChI=1S/C12H22O/c1-3-5-7-8-9-10-12-13-11-6-4-2/h3,9-10H,1,4-8,11-12H2,2H3/b10-9+ |
| InChIKey | DLDZPEXXODAGIH-MDZDMXLPSA-N |
| Mol Weight | 182.31 g/mol |
| Molecular Formula | C12H22O |
| Exact Mass | 182.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5PN8ODWa89b |
|---|---|
| Name | 2,7-Octadiene, 1-butoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.167065327 u |
| Formula | C12H22O |
| InChI | InChI=1S/C12H22O/c1-3-5-7-8-9-10-12-13-11-6-4-2/h3,9-10H,1,4-8,11-12H2,2H3/b10-9+ |
| InChIKey | DLDZPEXXODAGIH-MDZDMXLPSA-N |
| Molecular Weight | 182.307 g/mol |
| SMILES | CCCCOC\C=C\CCCC=C |