| SpectraBase Compound ID | 1Cx4EQEtmZX |
|---|---|
| InChI | InChI=1S/C19H28O5/c1-3-23-18(20)10-7-11-19(21)24-15-13-17(12-14-22-2)16-8-5-4-6-9-16/h4-6,8-9,17H,3,7,10-15H2,1-2H3 |
| InChIKey | VNGWIWCEQXRDCG-UHFFFAOYSA-N |
| Mol Weight | 336.43 g/mol |
| Molecular Formula | C19H28O5 |
| Exact Mass | 336.193674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EL2X8rLt61V |
|---|---|
| Name | Glutaric acid, ethyl 5-methoxy-3-phenylpentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.193673997 u |
| Formula | C19H28O5 |
| InChI | InChI=1S/C19H28O5/c1-3-23-18(20)10-7-11-19(21)24-15-13-17(12-14-22-2)16-8-5-4-6-9-16/h4-6,8-9,17H,3,7,10-15H2,1-2H3 |
| InChIKey | VNGWIWCEQXRDCG-UHFFFAOYSA-N |
| Molecular Weight | 336.428 g/mol |
| SMILES | C1=CC=C(C=C1)C(CCOC)CCOC(CCCC(OCC)=O)=O |