| SpectraBase Compound ID | Cba00VOBxHo |
|---|---|
| InChI | InChI=1S/C18H28O3/c1-4-6-12-17(13-18(19)20-5-2)15(3)21-14-16-10-8-7-9-11-16/h7-11,15,17H,4-6,12-14H2,1-3H3 |
| InChIKey | GXWWTJCEMYRWCI-UHFFFAOYSA-N |
| Mol Weight | 292.42 g/mol |
| Molecular Formula | C18H28O3 |
| Exact Mass | 292.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7LMpxntOHu9 |
|---|---|
| Name | Ethyl 3-(1-benzyloxyethyl)heptanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.203844759 u |
| Formula | C18H28O3 |
| InChI | InChI=1S/C18H28O3/c1-4-6-12-17(13-18(19)20-5-2)15(3)21-14-16-10-8-7-9-11-16/h7-11,15,17H,4-6,12-14H2,1-3H3 |
| InChIKey | GXWWTJCEMYRWCI-UHFFFAOYSA-N |
| Molecular Weight | 292.419 g/mol |
| SMILES | C(CC(CCCC)C(C)OCC1=CC=CC=C1)(=O)OCC |