| SpectraBase Compound ID | D81zY7JZyRW |
|---|---|
| InChI | InChI=1S/C15H28O4/c1-4-6-7-8-10-13(3)19-15(17)12-9-11-14(16)18-5-2/h13H,4-12H2,1-3H3 |
| InChIKey | ZZICNYDDMZYMRD-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 | 2XBQWX6M9mc |
|---|---|
| Name | Glutaric acid, ethyl 2-octylester |
| 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/c1-4-6-7-8-10-13(3)19-15(17)12-9-11-14(16)18-5-2/h13H,4-12H2,1-3H3 |
| InChIKey | ZZICNYDDMZYMRD-UHFFFAOYSA-N |
| SMILES | C(CCCC(OC(C)CCCCCC)=O)(OCC)=O |