| SpectraBase Compound ID | 6lN1S3eohdb |
|---|---|
| InChI | InChI=1S/C19H28O4/c1-5-15-10-7-8-11-17(15)23-19(21)13-9-12-18(20)22-16(6-2)14(3)4/h7-8,10-11,14,16H,5-6,9,12-13H2,1-4H3 |
| InChIKey | SUHVIPYBYRKAHP-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 | KZoefRsTPq6 |
|---|---|
| Name | Glutaric acid, 2-methylpent-3-yl 2-ethylphenyl 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/c1-5-15-10-7-8-11-17(15)23-19(21)13-9-12-18(20)22-16(6-2)14(3)4/h7-8,10-11,14,16H,5-6,9,12-13H2,1-4H3 |
| InChIKey | SUHVIPYBYRKAHP-UHFFFAOYSA-N |
| Molecular Weight | 320.429 g/mol |
| SMILES | C(CCC(OC(CC)C(C)C)=O)C(OC=1C(CC)=CC=CC1)=O |