| SpectraBase Compound ID | Jct2aguPzjs |
|---|---|
| InChI | InChI=1S/C21H13ClO/c22-20-12-6-1-7-14(20)13-19-15-8-2-4-10-17(15)21(23)18-11-5-3-9-16(18)19/h1-13H |
| InChIKey | LRHANTLWNDZCOO-UHFFFAOYSA-N |
| Mol Weight | 316.79 g/mol |
| Molecular Formula | C21H13ClO |
| Exact Mass | 316.065493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EYmC57B2C9t |
|---|---|
| Name | 10-(o-Chlorobenzylidene)anthrone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.065492738 u |
| Formula | C21H13ClO |
| InChI | InChI=1S/C21H13ClO/c22-20-12-6-1-7-14(20)13-19-15-8-2-4-10-17(15)21(23)18-11-5-3-9-16(18)19/h1-13H |
| InChIKey | LRHANTLWNDZCOO-UHFFFAOYSA-N |
| Molecular Weight | 316.787 g/mol |
| SMILES | C=12C=CC=CC1C(C=1C=CC=CC1C2=O)=CC=1C(=CC=CC1)Cl |