| SpectraBase Compound ID | LydKmS4a8EC |
|---|---|
| InChI | InChI=1S/C18H12Cl2O2/c19-15-9-4-10-16(18(15)20)22-17(21)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2 |
| InChIKey | GAISTWFBFLMFJV-UHFFFAOYSA-N |
| Mol Weight | 331.2 g/mol |
| Molecular Formula | C18H12Cl2O2 |
| Exact Mass | 330.021435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IqjIqSUpkbM |
|---|---|
| Name | 1-Naphthaleneacetic acid, 2,3-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.021435024 u |
| Formula | C18H12Cl2O2 |
| InChI | InChI=1S/C18H12Cl2O2/c19-15-9-4-10-16(18(15)20)22-17(21)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2 |
| InChIKey | GAISTWFBFLMFJV-UHFFFAOYSA-N |
| Molecular Weight | 331.198 g/mol |
| SMILES | C1=CC2=C(C=C1)C(=CC=C2)CC(=O)OC1=C(C(=CC=C1)Cl)Cl |