![N(ALPHA)-((TERT.-BUTYLOXY)-CARBONYL)-N(BETA)-[[(6-AMINO-4-(ETHOXYCARBONYL)-5-METHYLPYRIMIDIN-2-YL)-METHYLENE]-AMINO]-(S)-BETA-AMINOALANINE-AMIDE](/api/spectrum/FjM1lMhBO2p/structure.png?h=300&w=458 "N(ALPHA)-((TERT.-BUTYLOXY)-CARBONYL)-N(BETA)-[[(6-AMINO-4-(ETHOXYCARBONYL)-5-METHYLPYRIMIDIN-2-YL)-METHYLENE]-AMINO]-(S)-BETA-AMINOALANINE-AMIDE")
| SpectraBase Compound ID | 91EmyV13RiG |
|---|---|
| InChI | InChI=1S/C17H26N6O5/c1-6-27-15(25)12-9(2)13(18)23-11(22-12)8-20-7-10(14(19)24)21-16(26)28-17(3,4)5/h8,10H,6-7H2,1-5H3,(H2,19,24)(H,21,26)(H2,18,22,23)/b20-8+ |
| InChIKey | IKKWDALGCNJCHE-DNTJNYDQSA-N |
| Mol Weight | 394.43 g/mol |
| Molecular Formula | C17H26N6O5 |
| Exact Mass | 394.196468 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FjM1lMhBO2p |
|---|---|
| Name | N(ALPHA)-((TERT.-BUTYLOXY)-CARBONYL)-N(BETA)-[[(6-AMINO-4-(ETHOXYCARBONYL)-5-METHYLPYRIMIDIN-2-YL)-METHYLENE]-AMINO]-(S)-BETA-AMINOALANINE-AMIDE |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H26N6O5 |
| InChI | InChI=1S/C17H26N6O5/c1-6-27-15(25)12-9(2)13(18)23-11(22-12)8-20-7-10(14(19)24)21-16(26)28-17(3,4)5/h8,10H,6-7H2,1-5H3,(H2,19,24)(H,21,26)(H2,18,22,23)/b20-8+ |
| InChIKey | IKKWDALGCNJCHE-DNTJNYDQSA-N |
| Literature Reference Author | D.L.BOGER,T.HONDA,Q.DANG |
| Literature Reference Citation | J.AM.CHEM.SOC.,116,5619(1994) |
| Literature Reference DOI | 10.1021/ja00092a012 |
| Molecular Weight | 394.431 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU10830 |