| SpectraBase Compound ID | KqnKwvUs2cD |
|---|---|
| InChI | InChI=1S/C17H10Cl2O2/c18-14-5-1-11(2-6-14)9-13-10-16(21-17(13)20)12-3-7-15(19)8-4-12/h1-10H/b13-9+ |
| InChIKey | FVKNBYKHNNEYAJ-UKTHLTGXSA-N |
| Mol Weight | 317.17 g/mol |
| Molecular Formula | C17H10Cl2O2 |
| Exact Mass | 316.005785 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82V66uPVAnp |
|---|---|
| Name | 2(3H)-Furanone, 3-(4-chlorobenzylidene)-5-(4-chlorophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.005784960 u |
| Formula | C17H10Cl2O2 |
| InChI | InChI=1S/C17H10Cl2O2/c18-14-5-1-11(2-6-14)9-13-10-16(21-17(13)20)12-3-7-15(19)8-4-12/h1-10H/b13-9+ |
| InChIKey | FVKNBYKHNNEYAJ-UKTHLTGXSA-N |
| Molecular Weight | 317.171 g/mol |
| SMILES | C1=C(C=CC(=C1)Cl)\C=C\1C(OC(C2=CC=C(C=C2)Cl)=C1)=O |