| SpectraBase Compound ID | AYVCfie2EXJ |
|---|---|
| InChI | InChI=1S/C16H28O4/c1-13(17)19-15-9-6-4-3-5-7-10-16(12-8-11-15)20-14(2)18/h15-16H,3-12H2,1-2H3 |
| InChIKey | AWHVEVATZMBHBT-UHFFFAOYSA-N |
| Mol Weight | 284.4 g/mol |
| Molecular Formula | C16H28O4 |
| Exact Mass | 284.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LmYFY3glCN8 |
|---|---|
| Name | 5-(Acetyloxy)cyclododecyl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.198759378 u |
| Formula | C16H28O4 |
| InChI | InChI=1S/C16H28O4/c1-13(17)19-15-9-6-4-3-5-7-10-16(12-8-11-15)20-14(2)18/h15-16H,3-12H2,1-2H3 |
| InChIKey | AWHVEVATZMBHBT-UHFFFAOYSA-N |
| SMILES | C(=O)(OC1CCCC(CCCCCCC1)OC(=O)C)C |