![4-FLUORO-3-(2-[[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-AMINO]-ETHYL)-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-PENTANOIC-ACID](/api/spectrum/JPAMSxhlguq/structure.png?h=300&w=458 "4-FLUORO-3-(2-[[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-AMINO]-ETHYL)-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-PENTANOIC-ACID")
| SpectraBase Compound ID | HZunYBtvjHe |
|---|---|
| InChI | InChI=1S/C32H32FN3O5/c1-22-20-36(31(40)35-30(22)39)21-28(33)23(19-29(37)38)17-18-34-32(24-9-5-3-6-10-24,25-11-7-4-8-12-25)26-13-15-27(41-2)16-14-26/h3-16,20,34H,17-19,21H2,1-2H3,(H,37,38)(H,35,39,40)/b28-23- |
| InChIKey | RBQWBHGBOVXCFS-NFFVHWSESA-N |
| Mol Weight | 557.6 g/mol |
| Molecular Formula | C32H32FN3O5 |
| Exact Mass | 557.232599 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JPAMSxhlguq |
|---|---|
| Name | 4-FLUORO-3-(2-[[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-AMINO]-ETHYL)-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-PENTANOIC-ACID |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H32FN3O5 |
| InChI | InChI=1S/C32H32FN3O5/c1-22-20-36(31(40)35-30(22)39)21-28(33)23(19-29(37)38)17-18-34-32(24-9-5-3-6-10-24,25-11-7-4-8-12-25)26-13-15-27(41-2)16-14-26/h3-16,20,34H,17-19,21H2,1-2H3,(H,37,38)(H,35,39,40)/b28-23- |
| InChIKey | RBQWBHGBOVXCFS-NFFVHWSESA-N |
| Literature Reference Author | M.HOLLENSTEIN,C.J.LEUMANN |
| Literature Reference Citation | ORG.LETTERS,5,1987(2003) |
| Literature Reference DOI | 10.1021/ol034579s |
| Solvent | CDCl3 |
| Source File Reference | UWSI34249 |