| SpectraBase Compound ID | LwnCQ5fB4fK |
|---|---|
| InChI | InChI=1S/C18H32O4/c1-3-5-9-15(4-2)14-21-17(19)12-8-13-18(20)22-16-10-6-7-11-16/h15-16H,3-14H2,1-2H3 |
| InChIKey | XEQYCLJJTTVJPS-UHFFFAOYSA-N |
| Mol Weight | 312.5 g/mol |
| Molecular Formula | C18H32O4 |
| Exact Mass | 312.23006 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 | AQx3Gwj4c4L |
|---|---|
| Name | Glutaric acid, cyclopentyl 2-ethylhexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.230059506 u |
| Formula | C18H32O4 |
| InChI | InChI=1S/C18H32O4/c1-3-5-9-15(4-2)14-21-17(19)12-8-13-18(20)22-16-10-6-7-11-16/h15-16H,3-14H2,1-2H3 |
| InChIKey | XEQYCLJJTTVJPS-UHFFFAOYSA-N |
| Molecular Weight | 312.450 g/mol |
| SMILES | C(CCC(OCC(CC)CCCC)=O)C(OC1CCCC1)=O |