| SpectraBase Compound ID | DHgWgaZTSko |
|---|---|
| InChI | InChI=1S/C14H10N2O3/c17-14(12-6-8-15-9-7-12)5-4-11-2-1-3-13(10-11)16(18)19/h1-10H |
| InChIKey | JXHPGPGVSWYSSS-UHFFFAOYSA-N |
| Mol Weight | 254.24 g/mol |
| Molecular Formula | C14H10N2O3 |
| Exact Mass | 254.069142 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9YhceeeEyjJ |
|---|---|
| Name | 3-(m-Nitrophenyl)-1-(4-pyridyl)-2-propen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.069142187 u |
| Formula | C14H10N2O3 |
| InChI | InChI=1S/C14H10N2O3/c17-14(12-6-8-15-9-7-12)5-4-11-2-1-3-13(10-11)16(18)19/h1-10H |
| InChIKey | JXHPGPGVSWYSSS-UHFFFAOYSA-N |
| Molecular Weight | 254.245 g/mol |
| SMILES | N(=O)(=O)C=1C=CC=C(C1)C=CC(C=1C=CN=CC1)=O |