| SpectraBase Compound ID | KwNnOoHQFEW |
|---|---|
| InChI | InChI=1S/C15H12ClNO2/c1-10-3-2-4-12(17-10)6-8-15(19)13-9-11(16)5-7-14(13)18/h2-9,18H,1H3 |
| InChIKey | KQYFKCLMNDOABP-UHFFFAOYSA-N |
| Mol Weight | 273.72 g/mol |
| Molecular Formula | C15H12ClNO2 |
| Exact Mass | 273.055656 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Qwxx4vOh0g |
|---|---|
| Name | 5'-Chloro-2'-hydroxy-3-(6-methyl-2-pyridyl)acrylophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.055656328 u |
| Formula | C15H12ClNO2 |
| InChI | InChI=1S/C15H12ClNO2/c1-10-3-2-4-12(17-10)6-8-15(19)13-9-11(16)5-7-14(13)18/h2-9,18H,1H3 |
| InChIKey | KQYFKCLMNDOABP-UHFFFAOYSA-N |
| Molecular Weight | 273.719 g/mol |
| SMILES | OC1=C(C=C(C=C1)Cl)C(C=CC=1C=CC=C(N1)C)=O |