| SpectraBase Compound ID | 8Xv8JcA8XP |
|---|---|
| InChI | InChI=1S/C20H32O4/c1-13(2)14(3)24-19(22)8-6-7-18(21)23-12-15-9-10-16-11-17(15)20(16,4)5/h9,13-14,16-17H,6-8,10-12H2,1-5H3 |
| InChIKey | IJSKQCHCEDUKJI-UHFFFAOYSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C20H32O4 |
| Exact Mass | 336.23006 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 | 828tPYk9axt |
|---|---|
| Name | Glutaric acid, myrtenyl 3-methylbut-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.230059506 u |
| Formula | C20H32O4 |
| InChI | InChI=1S/C20H32O4/c1-13(2)14(3)24-19(22)8-6-7-18(21)23-12-15-9-10-16-11-17(15)20(16,4)5/h9,13-14,16-17H,6-8,10-12H2,1-5H3 |
| InChIKey | IJSKQCHCEDUKJI-UHFFFAOYSA-N |
| Molecular Weight | 336.472 g/mol |
| SMILES | C(CCC(OC(C(C)C)C)=O)C(OCC=1C2C(C(CC1)C2)(C)C)=O |