| SpectraBase Compound ID | AsEpJ4HFcCe |
|---|---|
| InChI | InChI=1S/C17H32O5/c1-6-7-8-12-20-15(18)10-9-11-16(19)22-14(2)13-21-17(3,4)5/h14H,6-13H2,1-5H3 |
| InChIKey | PEOMTZLMGYGTRC-UHFFFAOYSA-N |
| Mol Weight | 316.4 g/mol |
| Molecular Formula | C17H32O5 |
| Exact Mass | 316.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HanCttgAWmG |
|---|---|
| Name | Glutaric acid, 1-(tert-butoxy)prop-2-yl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.224974125 u |
| Formula | C17H32O5 |
| InChI | InChI=1S/C17H32O5/c1-6-7-8-12-20-15(18)10-9-11-16(19)22-14(2)13-21-17(3,4)5/h14H,6-13H2,1-5H3 |
| InChIKey | PEOMTZLMGYGTRC-UHFFFAOYSA-N |
| Molecular Weight | 316.438 g/mol |
| SMILES | C(CCCC(OC(C)COC(C)(C)C)=O)(OCCCCC)=O |