| SpectraBase Compound ID | AsPSNCV689g |
|---|---|
| InChI | InChI=1S/C14H18O2/c15-11-7-2-1-3-8-12-16-13-14-9-5-4-6-10-14/h1,3-6,9-11H,2,7-8,12-13H2/b3-1+ |
| InChIKey | SPEBRQJZTSFXME-HNQUOIGGSA-N |
| Mol Weight | 218.3 g/mol |
| Molecular Formula | C14H18O2 |
| Exact Mass | 218.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AEdkp1q4Qrt |
|---|---|
| Name | 7-Benzyloxy-(E)-hept-4-enal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.130679818 u |
| Formula | C14H18O2 |
| InChI | InChI=1S/C14H18O2/c15-11-7-2-1-3-8-12-16-13-14-9-5-4-6-10-14/h1,3-6,9-11H,2,7-8,12-13H2/b3-1+ |
| InChIKey | SPEBRQJZTSFXME-HNQUOIGGSA-N |
| Molecular Weight | 218.296 g/mol |
| SMILES | C(\C=C\CCC=O)COCC=1C=CC=CC1 |