| SpectraBase Compound ID | IxaHYtuDiN1 |
|---|---|
| InChI | InChI=1S/C15H28O4/c1-5-13(4)9-10-18-14(16)7-6-8-15(17)19-11-12(2)3/h12-13H,5-11H2,1-4H3 |
| InChIKey | XVLYHBWEYOZNBH-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 | 3YWEXEqhiNV |
|---|---|
| Name | Glutaric acid, isobutyl 3-methylpentyl 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/c1-5-13(4)9-10-18-14(16)7-6-8-15(17)19-11-12(2)3/h12-13H,5-11H2,1-4H3 |
| InChIKey | XVLYHBWEYOZNBH-UHFFFAOYSA-N |
| SMILES | CC(CCOC(CCCC(OCC(C)C)=O)=O)CC |