| SpectraBase Compound ID | 2B8tEnz5vq5 |
|---|---|
| InChI | InChI=1S/C15H28O4/c1-6-8-12(4)18-14(16)9-7-10-15(17)19-13(5)11(2)3/h11-13H,6-10H2,1-5H3 |
| InChIKey | QVNVLMWPUZFMKZ-UHFFFAOYSA-N |
| Mol Weight | 272.38 g/mol |
| Molecular Formula | C15H28O4 |
| Exact Mass | 272.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GooiwAknYi |
|---|---|
| Name | Glutaric acid, 3-methylbut-2-yl 2-pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.198759378 u |
| Formula | C15H28O4 |
| InChI | InChI=1S/C15H28O4/c1-6-8-12(4)18-14(16)9-7-10-15(17)19-13(5)11(2)3/h11-13H,6-10H2,1-5H3 |
| InChIKey | QVNVLMWPUZFMKZ-UHFFFAOYSA-N |
| SMILES | C(CCC(OC(C(C)C)C)=O)C(OC(C)CCC)=O |