| SpectraBase Compound ID | KubGtrnQAv3 |
|---|---|
| InChI | InChI=1S/C22H18N2O5/c25-20(15-5-2-1-3-6-15)13-19(17-7-4-12-23-14-17)21(22(26)27)16-8-10-18(11-9-16)24(28)29/h1-12,14,19,21H,13H2,(H,26,27)/t19-,21+/s2 |
| InChIKey | HCSAUYUFUXJMST-LMPOMZQGSA-N |
| Mol Weight | 390.4 g/mol |
| Molecular Formula | C22H18N2O5 |
| Exact Mass | 390.121572 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HVKsb5cUHHS |
|---|---|
| Name | erythro-a-(p-nitrophenyl)-b-phenacyl-3-pyridinepropionic acid |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H18N2O5 |
| InChI | InChI=1S/C22H18N2O5/c25-20(15-5-2-1-3-6-15)13-19(17-7-4-12-23-14-17)21(22(26)27)16-8-10-18(11-9-16)24(28)29/h1-12,14,19,21H,13H2,(H,26,27)/t19-,21+/s2 |
| InChIKey | HCSAUYUFUXJMST-LMPOMZQGSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 28783M |
| Solvent | Polysol |