| SpectraBase Compound ID | BiHjkcRtXAi |
|---|---|
| InChI | InChI=1S/C11H20O3/c1-3-4-5-6-9-10(14-9)7-8-11(12)13-2/h9-10H,3-8H2,1-2H3/t9-,10+/m0/s1 |
| InChIKey | QPIDVNHKMNEYNG-VHSXEESVSA-N |
| Mol Weight | 200.28 g/mol |
| Molecular Formula | C11H20O3 |
| Exact Mass | 200.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D2XzkecMxUz |
|---|---|
| Name | Methyl 3-[(2R,3S)-3-pentyloxiran-2-yl]propanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.141244501 u |
| Formula | C11H20O3 |
| InChI | InChI=1S/C11H20O3/c1-3-4-5-6-9-10(14-9)7-8-11(12)13-2/h9-10H,3-8H2,1-2H3/t9-,10+/m0/s1 |
| InChIKey | QPIDVNHKMNEYNG-VHSXEESVSA-N |
| Molecular Weight | 200.278 g/mol |
| SMILES | [C@@]1([C@@](O1)(CCCCC)[H])(CCC(=O)OC)[H] |