| SpectraBase Compound ID | JoaTYXbaMJZ |
|---|---|
| InChI | InChI=1S/C16H13ClO4/c1-10(18)21-15-9-13(20-2)7-8-14(15)16(19)11-3-5-12(17)6-4-11/h3-9H,1-2H3 |
| InChIKey | OHKSPSRHMRDTEV-UHFFFAOYSA-N |
| Mol Weight | 304.73 g/mol |
| Molecular Formula | C16H13ClO4 |
| Exact Mass | 304.050237 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GobVzT01IDd |
|---|---|
| Name | 4'-Chloro-2-hydroxy-4-methoxybenzophenone, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.050236595 u |
| Formula | C16H13ClO4 |
| InChI | InChI=1S/C16H13ClO4/c1-10(18)21-15-9-13(20-2)7-8-14(15)16(19)11-3-5-12(17)6-4-11/h3-9H,1-2H3 |
| InChIKey | OHKSPSRHMRDTEV-UHFFFAOYSA-N |
| Molecular Weight | 304.729 g/mol |
| SMILES | C1(Cl)=CC=C(C=C1)C(=O)C1=C(C=C(C=C1)OC)OC(C)=O |