![3-O-[1-(4-BENZYLPIPERAZINO)-2,2,2-TRIFLUOROETHYL]-1,2:5,6-DI-O-ISOPROPYLIDENE-ALPHA-D-GLUCOFURANOSE](/api/spectrum/KeoaNH7qVEg/structure.png?h=300&w=458 "3-O-[1-(4-BENZYLPIPERAZINO)-2,2,2-TRIFLUOROETHYL]-1,2:5,6-DI-O-ISOPROPYLIDENE-ALPHA-D-GLUCOFURANOSE")
| SpectraBase Compound ID | 4CWeCHk5XvN |
|---|---|
| InChI | InChI=1S/2C25H35F3N2O6/c2*1-23(2)31-15-17(34-23)18-19(20-21(32-18)36-24(3,4)35-20)33-22(25(26,27)28)30-12-10-29(11-13-30)14-16-8-6-5-7-9-16/h2*5-9,17-22H,10-15H2,1-4H3/t2*17?,18-,19+,20-,21-,22?/m11/s1 |
| InChIKey | FFJJJCAOBMJZSQ-JBSCEUFBSA-N |
| Mol Weight | 1033.1 g/mol |
| Molecular Formula | C50H70F6N4O12 |
| Exact Mass | 1032.489443 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KeoaNH7qVEg |
|---|---|
| Name | 3-O-[1-(4-BENZYLPIPERAZINO)-2,2,2-TRIFLUOROETHYL]-1,2:5,6-DI-O-ISOPROPYLIDENE-ALPHA-D-GLUCOFURANOSE |
| Compound Number | 2AE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H70F6N4O12 |
| InChI | InChI=1S/2C25H35F3N2O6/c2*1-23(2)31-15-17(34-23)18-19(20-21(32-18)36-24(3,4)35-20)33-22(25(26,27)28)30-12-10-29(11-13-30)14-16-8-6-5-7-9-16/h2*5-9,17-22H,10-15H2,1-4H3/t2*17?,18-,19+,20-,21-,22?/m11/s1 |
| InChIKey | FFJJJCAOBMJZSQ-JBSCEUFBSA-N |
| Literature Reference Author | T.BILLARD,B.R.LANGLOIS |
| Literature Reference Citation | J.ORG.CHEM.,67,997(2002) |
| Literature Reference DOI | 10.1021/jo016265t |
| Solvent | CDCl3 |
| Source File Reference | UWLU24880 |