| SpectraBase Compound ID | IZ2l8z3WxuO |
|---|---|
| InChI | InChI=1S/C18H17ClO4/c1-11(2)18(21)23-16-10-14(22-3)8-9-15(16)17(20)12-4-6-13(19)7-5-12/h4-11H,1-3H3 |
| InChIKey | XYRWFNFQVRCEQA-UHFFFAOYSA-N |
| Mol Weight | 332.78 g/mol |
| Molecular Formula | C18H17ClO4 |
| Exact Mass | 332.081537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1qMCNVliMxd |
|---|---|
| Name | 4'-Chloro-2-hydroxy-4-methoxybenzophenone, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.081536723 u |
| Formula | C18H17ClO4 |
| InChI | InChI=1S/C18H17ClO4/c1-11(2)18(21)23-16-10-14(22-3)8-9-15(16)17(20)12-4-6-13(19)7-5-12/h4-11H,1-3H3 |
| InChIKey | XYRWFNFQVRCEQA-UHFFFAOYSA-N |
| Molecular Weight | 332.783 g/mol |
| SMILES | C1(Cl)=CC=C(C=C1)C(=O)C1=C(C=C(C=C1)OC)OC(C(C)C)=O |