| SpectraBase Compound ID | 2sIeLklEN6D |
|---|---|
| InChI | InChI=1S/C15H22O6/c1-3-16-6-7-17-8-9-18-12(2)21-13-4-5-14-15(10-13)20-11-19-14/h4-5,10,12H,3,6-9,11H2,1-2H3 |
| InChIKey | WABPPBHOPMUJHV-UHFFFAOYSA-N |
| Mol Weight | 298.34 g/mol |
| Molecular Formula | C15H22O6 |
| Exact Mass | 298.141638 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GPepTFS5Kgw |
|---|---|
| Name | Sesamex |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.141638422 u |
| Formula | C15H22O6 |
| InChI | InChI=1S/C15H22O6/c1-3-16-6-7-17-8-9-18-12(2)21-13-4-5-14-15(10-13)20-11-19-14/h4-5,10,12H,3,6-9,11H2,1-2H3 |
| InChIKey | WABPPBHOPMUJHV-UHFFFAOYSA-N |
| Molecular Weight | 298.335 g/mol |
| SMILES | C(OC1=CC2=C(C=C1)OCO2)(OCCOCCOCC)C |