| SpectraBase Compound ID | 9WrZCMoSF5L |
|---|---|
| InChI | InChI=1S/C12H22O5/c1-3-8-16-11(13)6-5-7-12(14)17-10-9-15-4-2/h3-10H2,1-2H3 |
| InChIKey | CGJNVZLZYUOOJL-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 | 1EvFZzAilvI |
|---|---|
| Name | Glutaric acid, 2-ethoxyethyl propyl 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/c1-3-8-16-11(13)6-5-7-12(14)17-10-9-15-4-2/h3-10H2,1-2H3 |
| InChIKey | CGJNVZLZYUOOJL-UHFFFAOYSA-N |
| Molecular Weight | 246.303 g/mol |
| SMILES | CCCOC(CCCC(OCCOCC)=O)=O |