| SpectraBase Compound ID | 5Fs2J1QoYvj |
|---|---|
| InChI | InChI=1S/C11H20O2/c1-4-6-7-9-11(12)13-10(3)8-5-2/h5,8,10H,4,6-7,9H2,1-3H3/b8-5+ |
| InChIKey | FZHAUYVDIMRFJZ-VMPITWQZSA-N |
| Mol Weight | 184.28 g/mol |
| Molecular Formula | C11H20O2 |
| Exact Mass | 184.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7U6xcDpbPHp |
|---|---|
| Name | (E)-Pent-2-en-3-yl hexanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.146329882 u |
| Formula | C11H20O2 |
| InChI | InChI=1S/C11H20O2/c1-4-6-7-9-11(12)13-10(3)8-5-2/h5,8,10H,4,6-7,9H2,1-3H3/b8-5+ |
| InChIKey | FZHAUYVDIMRFJZ-VMPITWQZSA-N |
| Molecular Weight | 184.279 g/mol |
| SMILES | C\C=C\C(OC(CCCCC)=O)C |