| SpectraBase Compound ID | Ft05nLSQTez |
|---|---|
| InChI | InChI=1S/C16H30O3/c1-15(2,3)11-10-13(17)9-7-8-12-19-14(18)16(4,5)6/h10-11,13,17H,7-9,12H2,1-6H3/b11-10+/t13-/m0/s1 |
| InChIKey | FMHAXNZZRGQYKD-NHAQELONSA-N |
| Mol Weight | 270.41 g/mol |
| Molecular Formula | C16H30O3 |
| Exact Mass | 270.219495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KeZTmhoSLSt |
|---|---|
| Name | (E)-(S)-(+)-8,8-dimethyl-5-hydroxynon-6-enyl pivalate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.219494823 u |
| Formula | C16H30O3 |
| InChI | InChI=1S/C16H30O3/c1-15(2,3)11-10-13(17)9-7-8-12-19-14(18)16(4,5)6/h10-11,13,17H,7-9,12H2,1-6H3/b11-10+/t13-/m0/s1 |
| InChIKey | FMHAXNZZRGQYKD-NHAQELONSA-N |
| Molecular Weight | 270.413 g/mol |
| SMILES | C(C(C)(C)C)(=O)OCCCC[C@@](\C=C\C(C)(C)C)(O)[H] |