| SpectraBase Compound ID | JR21pbQWsCB |
|---|---|
| InChI | InChI=1S/C17H32O4/c1-12(16(3,4)5)20-14(18)10-9-11-15(19)21-13(2)17(6,7)8/h12-13H,9-11H2,1-8H3 |
| InChIKey | UOKCSQAAEINRQD-UHFFFAOYSA-N |
| Mol Weight | 300.4 g/mol |
| Molecular Formula | C17H32O4 |
| Exact Mass | 300.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AkB8uIhLRL9 |
|---|---|
| Name | Glutaric acid, di(3,3-dimethylbut-2-yl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.230059506 u |
| Formula | C17H32O4 |
| InChI | InChI=1S/C17H32O4/c1-12(16(3,4)5)20-14(18)10-9-11-15(19)21-13(2)17(6,7)8/h12-13H,9-11H2,1-8H3 |
| InChIKey | UOKCSQAAEINRQD-UHFFFAOYSA-N |
| SMILES | CC(OC(CCCC(OC(C(C)(C)C)C)=O)=O)C(C)(C)C |