| SpectraBase Compound ID | CI8aNXBwZA2 |
|---|---|
| InChI | InChI=1S/C14H18O3/c1-3-4-5-6-10-17-14(15)12-8-7-9-13(11-12)16-2/h6-11H,3-5H2,1-2H3/b10-6+ |
| InChIKey | VIXYUCWINLBIDJ-UXBLZVDNSA-N |
| Mol Weight | 234.29 g/mol |
| Molecular Formula | C14H18O3 |
| Exact Mass | 234.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2HXO8xPldFa |
|---|---|
| Name | (E)-hex-1-Enyl 3-methoxybenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.125594437 u |
| Formula | C14H18O3 |
| InChI | InChI=1S/C14H18O3/c1-3-4-5-6-10-17-14(15)12-8-7-9-13(11-12)16-2/h6-11H,3-5H2,1-2H3/b10-6+ |
| InChIKey | VIXYUCWINLBIDJ-UXBLZVDNSA-N |
| Molecular Weight | 234.295 g/mol |
| SMILES | CCCC\C=C\OC(C1=CC=CC(=C1)OC)=O |