![(2R)-2-HEPT-6-ENYL-5-IODO-1-[(E)-[[(1S)-1-(METHOXYMETHYL)-2-METHYLPROPYL]-IMINO]-(PHENYL)-METHYL]-2,3-DIHYDROPYRIDIN-4(1H)-ONE](/api/spectrum/9somp42kJMY/structure.png?h=300&w=458 "(2R)-2-HEPT-6-ENYL-5-IODO-1-[(E)-[[(1S)-1-(METHOXYMETHYL)-2-METHYLPROPYL]-IMINO]-(PHENYL)-METHYL]-2,3-DIHYDROPYRIDIN-4(1H)-ONE")
| SpectraBase Compound ID | FSG3CX9p7UB |
|---|---|
| InChI | InChI=1S/C25H35IN2O2/c1-5-6-7-8-12-15-21-16-24(29)22(26)17-28(21)25(20-13-10-9-11-14-20)27-23(18-30-4)19(2)3/h5,9-11,13-14,17,19,21,23H,1,6-8,12,15-16,18H2,2-4H3/b27-25+/t21-,23+/m1/s1 |
| InChIKey | XVARYOPMNYDECF-WNDISTBRSA-N |
| Mol Weight | 522.5 g/mol |
| Molecular Formula | C25H35IN2O2 |
| Exact Mass | 522.174323 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9somp42kJMY |
|---|---|
| Name | (2R)-2-HEPT-6-ENYL-5-IODO-1-[(E)-[[(1S)-1-(METHOXYMETHYL)-2-METHYLPROPYL]-IMINO]-(PHENYL)-METHYL]-2,3-DIHYDROPYRIDIN-4(1H)-ONE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H35IN2O2 |
| InChI | InChI=1S/C25H35IN2O2/c1-5-6-7-8-12-15-21-16-24(29)22(26)17-28(21)25(20-13-10-9-11-14-20)27-23(18-30-4)19(2)3/h5,9-11,13-14,17,19,21,23H,1,6-8,12,15-16,18H2,2-4H3/b27-25+/t21-,23+/m1/s1 |
| InChIKey | XVARYOPMNYDECF-WNDISTBRSA-N |
| Literature Reference Author | T.FOCKEN,A.B.CHARETTE |
| Literature Reference Citation | ORG.LETTERS,8,2985(2006) |
| Literature Reference DOI | 10.1021/ol0609006 |
| Molecular Weight | 522.470 g/mol |
| Sample ID | 58143 |
| Solvent | CDCl3 |