| SpectraBase Compound ID | 1KIicXsU20u |
|---|---|
| InChI | InChI=1S/C11H20O6/c1-14-9(15-2)7-5-6-8(10(12)16-3)11(13)17-4/h8-9H,5-7H2,1-4H3 |
| InChIKey | CIFVTCCFEUKNQP-UHFFFAOYSA-N |
| Mol Weight | 248.27 g/mol |
| Molecular Formula | C11H20O6 |
| Exact Mass | 248.125988 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C8TOWkdQ8dj |
|---|---|
| Name | Propanedioic acid, (4,4-dimethoxybutyl)-, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.125988358 u |
| Formula | C11H20O6 |
| InChI | InChI=1S/C11H20O6/c1-14-9(15-2)7-5-6-8(10(12)16-3)11(13)17-4/h8-9H,5-7H2,1-4H3 |
| InChIKey | CIFVTCCFEUKNQP-UHFFFAOYSA-N |
| Molecular Weight | 248.275 g/mol |
| SMILES | C(C(=O)OC)(C(=O)OC)CCCC(OC)OC |