| SpectraBase Compound ID | H5IyjDxLMg1 |
|---|---|
| InChI | InChI=1S/C19H19ClO4/c20-16-8-4-9-17(14-16)24-19(22)11-5-10-18(21)23-13-12-15-6-2-1-3-7-15/h1-4,6-9,14H,5,10-13H2 |
| InChIKey | NLGBBVIIVWUUEM-UHFFFAOYSA-N |
| Mol Weight | 346.81 g/mol |
| Molecular Formula | C19H19ClO4 |
| Exact Mass | 346.097187 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 | 4G9JdiLvwnG |
|---|---|
| Name | Glutaric acid, 3-chlorophenyl phenethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.097186788 u |
| Formula | C19H19ClO4 |
| InChI | InChI=1S/C19H19ClO4/c20-16-8-4-9-17(14-16)24-19(22)11-5-10-18(21)23-13-12-15-6-2-1-3-7-15/h1-4,6-9,14H,5,10-13H2 |
| InChIKey | NLGBBVIIVWUUEM-UHFFFAOYSA-N |
| Molecular Weight | 346.810 g/mol |
| SMILES | C(CCC(OC1=CC(=CC=C1)Cl)=O)C(OCCC1=CC=CC=C1)=O |