| SpectraBase Compound ID | 6ATwwKkQGTo |
|---|---|
| InChI | InChI=1S/C10H18O5/c1-4-14-9(11)6-13-7-10(12)15-5-8(2)3/h8H,4-7H2,1-3H3 |
| InChIKey | MHJYPHKVVMLGGZ-UHFFFAOYSA-N |
| Mol Weight | 218.25 g/mol |
| Molecular Formula | C10H18O5 |
| Exact Mass | 218.115424 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AocKFCtXnMM |
|---|---|
| Name | Diglycolic acid, ethyl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.115423675 u |
| Formula | C10H18O5 |
| InChI | InChI=1S/C10H18O5/c1-4-14-9(11)6-13-7-10(12)15-5-8(2)3/h8H,4-7H2,1-3H3 |
| InChIKey | MHJYPHKVVMLGGZ-UHFFFAOYSA-N |
| Molecular Weight | 218.249 g/mol |
| SMILES | C(COCC(=O)OCC)(=O)OCC(C)C |