| SpectraBase Compound ID | 98Ls2PHNK09 |
|---|---|
| InChI | InChI=1S/C13H24O4/c1-4-16-12(14)8-5-9-13(15)17-10-6-7-11(2)3/h11H,4-10H2,1-3H3 |
| InChIKey | ZMZOQNYEFASINJ-UHFFFAOYSA-N |
| Mol Weight | 244.33 g/mol |
| Molecular Formula | C13H24O4 |
| Exact Mass | 244.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4Us95jXTnHu |
|---|---|
| Name | Glutaric acid, ethyl isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.167459249 u |
| Formula | C13H24O4 |
| InChI | InChI=1S/C13H24O4/c1-4-16-12(14)8-5-9-13(15)17-10-6-7-11(2)3/h11H,4-10H2,1-3H3 |
| InChIKey | ZMZOQNYEFASINJ-UHFFFAOYSA-N |
| Molecular Weight | 244.331 g/mol |
| SMILES | CC(C)CCCOC(CCCC(OCC)=O)=O |