| SpectraBase Compound ID | 7PaCJOSt6bF |
|---|---|
| InChI | InChI=1S/C22H26F2N4O4.C2HF3O2/c1-14(2)12-22(18(23)24,28-21(30)31-13-15-6-4-3-5-7-15)19(29)32-17-10-8-16(9-11-17)27-20(25)26;3-2(4,5)1(6)7/h3-11,14,18H,12-13H2,1-2H3,(H,28,30)(H4,25,26,27);(H,6,7) |
| InChIKey | DMQANSUMCSULHM-UHFFFAOYSA-N |
| Mol Weight | 562.494 g/mol |
| Molecular Formula | C24H27F5N4O6 |
| Exact Mass | 562.185075 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EN1YE0pJs7F |
|---|---|
| Name | 4-GUANIDINOPHENYL-N-(BENZYLOXYCARBONYL)-(ALPHA-DIFLUOROMETHYL)-LEUCINATE-TRIFLUOROACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H27F5N4O6 |
| InChI | InChI=1S/C22H26F2N4O4.C2HF3O2/c1-14(2)12-22(18(23)24,28-21(30)31-13-15-6-4-3-5-7-15)19(29)32-17-10-8-16(9-11-17)27-20(25)26;3-2(4,5)1(6)7/h3-11,14,18H,12-13H2,1-2H3,(H,28,30)(H4,25,26,27);(H,6,7) |
| InChIKey | DMQANSUMCSULHM-UHFFFAOYSA-N |
| Literature Reference Author | S.THUST,B.KOKSCH |
| Literature Reference Citation | J.ORG.CHEM.,68,2290(2003) |
| Literature Reference DOI | 10.1021/jo020613p |
| Solvent | DMSO |
| Source File Reference | UWVN25179 |