| SpectraBase Compound ID | 6PvRDP4ximH |
|---|---|
| InChI | InChI=1S/C19H36O4/c1-5-7-11-17(6-2)15-23-19(21)13-8-12-18(20)22-14-9-10-16(3)4/h16-17H,5-15H2,1-4H3 |
| InChIKey | ZOLJFNPPAPLVIU-UHFFFAOYSA-N |
| Mol Weight | 328.5 g/mol |
| Molecular Formula | C19H36O4 |
| Exact Mass | 328.26136 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 | dQtiihZTIV |
|---|---|
| Name | Glutaric acid, 2-ethylhexyl isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.261359635 u |
| Formula | C19H36O4 |
| InChI | InChI=1S/C19H36O4/c1-5-7-11-17(6-2)15-23-19(21)13-8-12-18(20)22-14-9-10-16(3)4/h16-17H,5-15H2,1-4H3 |
| InChIKey | ZOLJFNPPAPLVIU-UHFFFAOYSA-N |
| Molecular Weight | 328.493 g/mol |
| SMILES | CC(C)CCCOC(CCCC(OCC(CCCC)CC)=O)=O |