![[(E)-1-butoxyhex-1-enyl]benzene](/api/spectrum/9NEEY3H4gTw/structure.png?h=300&w=458 "[(E)-1-butoxyhex-1-enyl]benzene")
| SpectraBase Compound ID | 5Rgrjear8dF |
|---|---|
| InChI | InChI=1S/C16H24O/c1-3-5-8-13-16(17-14-6-4-2)15-11-9-7-10-12-15/h7,9-13H,3-6,8,14H2,1-2H3/b16-13+ |
| InChIKey | WEGVSEOPAKKQAB-DTQAZKPQSA-N |
| Mol Weight | 232.37 g/mol |
| Molecular Formula | C16H24O |
| Exact Mass | 232.182715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9NEEY3H4gTw |
|---|---|
| Name | [(E)-1-Butoxyhex-1-enyl]benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.182715392 u |
| Formula | C16H24O |
| InChI | InChI=1S/C16H24O/c1-3-5-8-13-16(17-14-6-4-2)15-11-9-7-10-12-15/h7,9-13H,3-6,8,14H2,1-2H3/b16-13+ |
| InChIKey | WEGVSEOPAKKQAB-DTQAZKPQSA-N |
| Molecular Weight | 232.367 g/mol |
| SMILES | C1(\C(=C/CCCC)OCCCC)=CC=CC=C1 |