| SpectraBase Compound ID | KDpQg1dkqdg |
|---|---|
| InChI | InChI=1S/C12H22O5/c1-9(2)10(3)17-12(14)6-5-11(13)16-8-7-15-4/h9-10H,5-8H2,1-4H3 |
| InChIKey | KWGDYNAFAFLTHI-UHFFFAOYSA-N |
| Mol Weight | 246.3 g/mol |
| Molecular Formula | C12H22O5 |
| Exact Mass | 246.146724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2UQYLCh172w |
|---|---|
| Name | Succinic acid, 3-methylbut-2-yl 2-methoxyethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.146723803 u |
| Formula | C12H22O5 |
| InChI | InChI=1S/C12H22O5/c1-9(2)10(3)17-12(14)6-5-11(13)16-8-7-15-4/h9-10H,5-8H2,1-4H3 |
| InChIKey | KWGDYNAFAFLTHI-UHFFFAOYSA-N |
| Molecular Weight | 246.303 g/mol |
| SMILES | C(CC(OC(C(C)C)C)=O)C(OCCOC)=O |