![Methyl 6-[(tetrahydropyran-2-yl)oxy]hex-2(E)-enoate](/api/spectrum/87Xs9fwDcrT/structure.png?h=300&w=458 "Methyl 6-[(tetrahydropyran-2-yl)oxy]hex-2(E)-enoate")
| SpectraBase Compound ID | LH6Z5WQAqRm |
|---|---|
| InChI | InChI=1S/C12H20O4/c1-14-11(13)7-3-2-5-9-15-12-8-4-6-10-16-12/h3,7,12H,2,4-6,8-10H2,1H3/b7-3+ |
| InChIKey | MXYKHVMAQDDEBF-XVNBXDOJSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C12H20O4 |
| Exact Mass | 228.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 87Xs9fwDcrT |
|---|---|
| Name | Methyl 6-[(tetrahydropyran-2-yl)oxy]hex-2(E)-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.136159120 u |
| Formula | C12H20O4 |
| InChI | InChI=1S/C12H20O4/c1-14-11(13)7-3-2-5-9-15-12-8-4-6-10-16-12/h3,7,12H,2,4-6,8-10H2,1H3/b7-3+ |
| InChIKey | MXYKHVMAQDDEBF-XVNBXDOJSA-N |
| Molecular Weight | 228.288 g/mol |
| SMILES | C(\C=C\CCCOC1OCCCC1)(=O)OC |