| SpectraBase Compound ID | JpLdO3fQbF5 |
|---|---|
| InChI | InChI=1S/C22H25F3N4O4.C2HF3O2/c1-14(2)12-21(22(23,24)25,29-20(31)32-13-15-6-4-3-5-7-15)18(30)33-17-10-8-16(9-11-17)28-19(26)27;3-2(4,5)1(6)7/h3-11,14H,12-13H2,1-2H3,(H,29,31)(H4,26,27,28);(H,6,7) |
| InChIKey | ACJLQCPPONBYOR-UHFFFAOYSA-N |
| Mol Weight | 580.484 g/mol |
| Molecular Formula | C24H26F6N4O6 |
| Exact Mass | 580.175654 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G0l9u6IjDnr |
|---|---|
| Name | 4-GUANIDINOPHENYL-N-(BENZYLOXYCARBONYL)-(ALPHA-TRIFLUOROMETHYL)-LEUCINATE-TRIFLUOROACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H26F6N4O6 |
| InChI | InChI=1S/C22H25F3N4O4.C2HF3O2/c1-14(2)12-21(22(23,24)25,29-20(31)32-13-15-6-4-3-5-7-15)18(30)33-17-10-8-16(9-11-17)28-19(26)27;3-2(4,5)1(6)7/h3-11,14H,12-13H2,1-2H3,(H,29,31)(H4,26,27,28);(H,6,7) |
| InChIKey | ACJLQCPPONBYOR-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 | 580.484 g/mol |
| Solvent | DMSO |
| Source File Reference | UWVN25178 |