| SpectraBase Compound ID | 4LkBnNhIdD5 |
|---|---|
| InChI | InChI=1S/C25H26N4O4.C2HF3O2/c1-25(16-18-8-4-2-5-9-18,29-24(31)32-17-19-10-6-3-7-11-19)22(30)33-21-14-12-20(13-15-21)28-23(26)27;3-2(4,5)1(6)7/h2-15H,16-17H2,1H3,(H,29,31)(H4,26,27,28);(H,6,7) |
| InChIKey | ZMPROKMHDGEDGN-UHFFFAOYSA-N |
| Mol Weight | 560.53 g/mol |
| Molecular Formula | C27H27F3N4O6 |
| Exact Mass | 560.188269 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GO35kF4vclh |
|---|---|
| Name | 4-GUANIDINOPHENYL-N-(BENZYLOXYCARBONYL)-(ALPHA-METHYL)-L-PHENYLALANINATE-TRIFLUOROACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H27F3N4O6 |
| InChI | InChI=1S/C25H26N4O4.C2HF3O2/c1-25(16-18-8-4-2-5-9-18,29-24(31)32-17-19-10-6-3-7-11-19)22(30)33-21-14-12-20(13-15-21)28-23(26)27;3-2(4,5)1(6)7/h2-15H,16-17H2,1H3,(H,29,31)(H4,26,27,28);(H,6,7) |
| InChIKey | ZMPROKMHDGEDGN-UHFFFAOYSA-N |
| Literature Reference Author | S.THUST,B.KOKSCH |
| Literature Reference Citation | J.ORG.CHEM.,68,2290(2003) |
| Literature Reference DOI | 10.1021/jo020613p |
| Molecular Weight | 560.530 g/mol |
| Solvent | DMSO |
| Source File Reference | UWVN25182 |