| SpectraBase Compound ID | 4dfThED8Yd5 |
|---|---|
| InChI | InChI=1S/C14H10BrNO2/c15-11-4-6-14(18)12(8-11)13(17)5-3-10-2-1-7-16-9-10/h1-9,18H |
| InChIKey | OYJFXYTWHZAQPD-UHFFFAOYSA-N |
| Mol Weight | 304.14 g/mol |
| Molecular Formula | C14H10BrNO2 |
| Exact Mass | 302.989492 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jn1teJUCUPw |
|---|---|
| Name | 5'-Bromo-2'-hydroxy-3-(3-pyridyl)acrylophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.989491564 u |
| Formula | C14H10BrNO2 |
| InChI | InChI=1S/C14H10BrNO2/c15-11-4-6-14(18)12(8-11)13(17)5-3-10-2-1-7-16-9-10/h1-9,18H |
| InChIKey | OYJFXYTWHZAQPD-UHFFFAOYSA-N |
| Molecular Weight | 304.143 g/mol |
| SMILES | OC1=C(C=C(Br)C=C1)C(=O)C=CC=1C=NC=CC1 |