| SpectraBase Compound ID | Lb1SahvIhhz |
|---|---|
| InChI | InChI=1S/C17H32O4/c1-4-5-6-7-9-12-16(21-15(2)18)13-10-8-11-14-17(19)20-3/h16H,4-14H2,1-3H3 |
| InChIKey | OTNPWZDGZRWZQJ-UHFFFAOYSA-N |
| Mol Weight | 300.4 g/mol |
| Molecular Formula | C17H32O4 |
| Exact Mass | 300.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FOPa9EFwlqB |
|---|---|
| Name | Methyl 7-acetoxytetradecanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.230059506 u |
| Formula | C17H32O4 |
| InChI | InChI=1S/C17H32O4/c1-4-5-6-7-9-12-16(21-15(2)18)13-10-8-11-14-17(19)20-3/h16H,4-14H2,1-3H3 |
| InChIKey | OTNPWZDGZRWZQJ-UHFFFAOYSA-N |
| SMILES | COC(CCCCCC(OC(=O)C)CCCCCCC)=O |