| SpectraBase Compound ID | 7hEsoqcHWt4 |
|---|---|
| InChI | InChI=1S/C12H18O8/c1-7(13)15-3-9-11-12(20-5-17-9)10(18-6-19-11)4-16-8(2)14/h9-12H,3-6H2,1-2H3 |
| InChIKey | DLKUXUOKMVCLLB-UHFFFAOYSA-N |
| Mol Weight | 290.27 g/mol |
| Molecular Formula | C12H18O8 |
| Exact Mass | 290.100168 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 921SABs5hE3 |
|---|---|
| Name | 2,4:3,5-Dimethylene-L-iditol diacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.100167532 u |
| Formula | C12H18O8 |
| InChI | InChI=1S/C12H18O8/c1-7(13)15-3-9-11-12(20-5-17-9)10(18-6-19-11)4-16-8(2)14/h9-12H,3-6H2,1-2H3 |
| InChIKey | DLKUXUOKMVCLLB-UHFFFAOYSA-N |
| SMILES | C1OC(C2C(O1)C(OCO2)COC(=O)C)COC(=O)C |