| SpectraBase Compound ID | 2qm99PBUcR2 |
|---|---|
| InChI | InChI=1S/C19H28O4/c1-5-17(16-10-7-6-8-11-16)23-19(21)13-9-12-18(20)22-15(4)14(2)3/h6-8,10-11,14-15,17H,5,9,12-13H2,1-4H3 |
| InChIKey | RGZNQFLPFKBKMG-UHFFFAOYSA-N |
| Mol Weight | 320.43 g/mol |
| Molecular Formula | C19H28O4 |
| Exact Mass | 320.198759 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 | C4t7yd365bR |
|---|---|
| Name | Glutaric acid, 3-methylbut-2-yl 1-phenylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.198759378 u |
| Formula | C19H28O4 |
| InChI | InChI=1S/C19H28O4/c1-5-17(16-10-7-6-8-11-16)23-19(21)13-9-12-18(20)22-15(4)14(2)3/h6-8,10-11,14-15,17H,5,9,12-13H2,1-4H3 |
| InChIKey | RGZNQFLPFKBKMG-UHFFFAOYSA-N |
| Molecular Weight | 320.429 g/mol |
| SMILES | C(CCC(OC(C(C)C)C)=O)C(OC(CC)C1=CC=CC=C1)=O |