| SpectraBase Compound ID | 1aO9x8QhyK8 |
|---|---|
| InChI | InChI=1S/C34H31F5N4O6.Ni/c1-18(20-10-5-6-11-22(20)41-32(45)23-12-7-13-42(23)17-19-8-3-2-4-9-19)40-31(33(46)47)21(16-24(44)43-14-15-49-34(43)48)25-26(35)28(37)30(39)29(38)27(25)36;/h2-6,8-11,21,23,31H,7,12-17H2,1H3,(H2,40,41,45,46,47);/q;+2/p-2/t21-,23-,31+;/m0./s1 |
| InChIKey | LDQDMGAPANZQNT-UOYPAMBCSA-L |
| Mol Weight | 743.3 g/mol |
| Molecular Formula | C34H29F5N4NiO6 |
| Exact Mass | 742.136067 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KHDQU7FfZDn |
|---|---|
| Name | LDQDMGAPANZQNT-UOYPAMBCSA-L |
| Compound Number | 7P |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H29F5N4NiO6 |
| InChI | InChI=1S/C34H31F5N4O6.Ni/c1-18(20-10-5-6-11-22(20)41-32(45)23-12-7-13-42(23)17-19-8-3-2-4-9-19)40-31(33(46)47)21(16-24(44)43-14-15-49-34(43)48)25-26(35)28(37)30(39)29(38)27(25)36;/h2-6,8-11,21,23,31H,7,12-17H2,1H3,(H2,40,41,45,46,47);/q;+2/p-2/t21-,23-,31+;/m0./s1 |
| InChIKey | LDQDMGAPANZQNT-UOYPAMBCSA-L |
| Literature Reference Author | C.CAI,V.A.SOLOSHONOK,V.J.HRUBY |
| Literature Reference Citation | J.ORG.CHEM.,66,1339(2001) |
| Literature Reference DOI | 10.1021/jo0014865 |
| Solvent | CDCl3 |
| Source File Reference | UWMS25897 |