| SpectraBase Compound ID | 19obCHaZSQC |
|---|---|
| InChI | InChI=1S/C16H30O5/c1-12(2)10-19-14(17)8-7-9-15(18)21-13(3)11-20-16(4,5)6/h12-13H,7-11H2,1-6H3 |
| InChIKey | QXQCGESRLQPGIO-UHFFFAOYSA-N |
| Mol Weight | 302.41 g/mol |
| Molecular Formula | C16H30O5 |
| Exact Mass | 302.209324 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LA0NjVh8qIP |
|---|---|
| Name | Glutaric acid, 1-(tert-butoxy)prop-2-yl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.209324061 u |
| Formula | C16H30O5 |
| InChI | InChI=1S/C16H30O5/c1-12(2)10-19-14(17)8-7-9-15(18)21-13(3)11-20-16(4,5)6/h12-13H,7-11H2,1-6H3 |
| InChIKey | QXQCGESRLQPGIO-UHFFFAOYSA-N |
| SMILES | C(CCCC(OC(COC(C)(C)C)C)=O)(OCC(C)C)=O |