| SpectraBase Compound ID | 1p4oBhDOqtC |
|---|---|
| InChI | InChI=1S/C20H36O4/c1-3-5-7-9-10-11-13-18-24-20(22)16-14-15-19(21)23-17-12-8-6-4-2/h10-11H,3-9,12-18H2,1-2H3/b11-10- |
| InChIKey | DFGWOANVHMFKGA-KHPPLWFESA-N |
| Mol Weight | 340.5 g/mol |
| Molecular Formula | C20H36O4 |
| Exact Mass | 340.26136 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 | BL9fjJk3pjU |
|---|---|
| Name | Glutraic acid, cis-non-3-enyl hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.261359635 u |
| Formula | C20H36O4 |
| InChI | InChI=1S/C20H36O4/c1-3-5-7-9-10-11-13-18-24-20(22)16-14-15-19(21)23-17-12-8-6-4-2/h10-11H,3-9,12-18H2,1-2H3/b11-10- |
| InChIKey | DFGWOANVHMFKGA-KHPPLWFESA-N |
| Molecular Weight | 340.504 g/mol |
| SMILES | C(\C=C/CCCCC)COC(CCCC(=O)OCCCCCC)=O |