| SpectraBase Compound ID | csJk60Ei8C |
|---|---|
| InChI | InChI=1S/C17H16Cl2O4/c18-15(19)11-22-16(20)9-4-10-17(21)23-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15H,4,9-11H2 |
| InChIKey | XAJYBUQLAGXQES-UHFFFAOYSA-N |
| Mol Weight | 355.22 g/mol |
| Molecular Formula | C17H16Cl2O4 |
| Exact Mass | 354.042564 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DjC8OMwDrmP |
|---|---|
| Name | Glutaric acid, 2,2-dichloroethyl 1-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.042564391 u |
| Formula | C17H16Cl2O4 |
| InChI | InChI=1S/C17H16Cl2O4/c18-15(19)11-22-16(20)9-4-10-17(21)23-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15H,4,9-11H2 |
| InChIKey | XAJYBUQLAGXQES-UHFFFAOYSA-N |
| Molecular Weight | 355.217 g/mol |
| SMILES | C(CCC(OCC(Cl)Cl)=O)C(OC=1C2=C(C=CC1)C=CC=C2)=O |