| SpectraBase Compound ID | E65rWXcHvl6 |
|---|---|
| InChI | InChI=1S/C12H8Cl2O2/c13-11(14)12(15)16-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H |
| InChIKey | BINBEEOLDVVDPS-UHFFFAOYSA-N |
| Mol Weight | 255.1 g/mol |
| Molecular Formula | C12H8Cl2O2 |
| Exact Mass | 253.990135 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ALr7eKTJXPq |
|---|---|
| Name | Dichloroacetic acid, 2-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.990134896 u |
| Formula | C12H8Cl2O2 |
| InChI | InChI=1S/C12H8Cl2O2/c13-11(14)12(15)16-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H |
| InChIKey | BINBEEOLDVVDPS-UHFFFAOYSA-N |
| Molecular Weight | 255.100 g/mol |
| SMILES | C1=CC2=CC(OC(C(Cl)Cl)=O)=CC=C2C=C1 |