![(1R,14S)-13-oxabicyclo[12.4.0]octadecan-12-one](/api/spectrum/6lZ0BofvWRl/structure.png?h=300&w=458 "(1R,14S)-13-oxabicyclo[12.4.0]octadecan-12-one")
| SpectraBase Compound ID | JWDDNTtJd1u |
|---|---|
| InChI | InChI=1S/C17H30O2/c18-17-14-8-6-4-2-1-3-5-7-11-15-12-9-10-13-16(15)19-17/h15-16H,1-14H2/t15-,16+/m1/s1 |
| InChIKey | OTBAMRDQABUXNJ-CVEARBPZSA-N |
| Mol Weight | 266.42 g/mol |
| Molecular Formula | C17H30O2 |
| Exact Mass | 266.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6lZ0BofvWRl |
|---|---|
| Name | (1R,14S)-13-Oxabicyclo[12.4.0]octadecan-12-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.224580204 u |
| Formula | C17H30O2 |
| InChI | InChI=1S/C17H30O2/c18-17-14-8-6-4-2-1-3-5-7-11-15-12-9-10-13-16(15)19-17/h15-16H,1-14H2/t15-,16+/m1/s1 |
| InChIKey | OTBAMRDQABUXNJ-CVEARBPZSA-N |
| Molecular Weight | 266.425 g/mol |
| SMILES | C1(O[C@@]2([C@](CCCCCCCCCC1)(CCCC2)[H])[H])=O |