| SpectraBase Compound ID | F9vnO7LWEp6 |
|---|---|
| InChI | InChI=1S/C53H64F3N11O8.HI/c1-50(2)35-15-6-8-18-39(35)66(5)41(50)20-14-21-42-51(3,4)36-16-7-9-19-40(36)67(42)30-13-11-22-44(69)58-29-12-10-17-37(62-47(72)33-23-25-34(26-24-33)52(64-65-52)53(54,55)56)48(73)60-31-45(70)59-32-46(71)61-38(49(74)63-75)27-28-43(57)68;/h6-9,14-16,18-21,23-26,37-38H,10-13,17,22,27-32H2,1-5H3,(H8-,57,58,59,60,61,62,63,64,65,68,69,70,71,72,73,74,75);1H/t37-,38+;/m1./s1 |
| InChIKey | LVMWAKOMEHSQHW-HANFNJKSSA-N |
| Mol Weight | 1168.1 g/mol |
| Molecular Formula | C53H65F3IN11O8 |
| Exact Mass | 1167.401438 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hyz555uRFmm |
|---|---|
| Name | LVMWAKOMEHSQHW-HANFNJKSSA-N |
| Compound Number | 5I |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H64F3IN11O8 |
| InChI | InChI=1S/C53H64F3N11O8.HI/c1-50(2)35-15-6-8-18-39(35)66(5)41(50)20-14-21-42-51(3,4)36-16-7-9-19-40(36)67(42)30-13-11-22-44(69)58-29-12-10-17-37(62-47(72)33-23-25-34(26-24-33)52(64-65-52)53(54,55)56)48(73)60-31-45(70)59-32-46(71)61-38(49(74)63-75)27-28-43(57)68;/h6-9,14-16,18-21,23-26,37-38H,10-13,17,22,27-32H2,1-5H3,(H8-,57,58,59,60,61,62,63,64,65,68,69,70,71,72,73,74,75);1H/t37-,38+;/m1./s1 |
| InChIKey | LVMWAKOMEHSQHW-HANFNJKSSA-N |
| Literature Reference Author | E.W.S.CHAN,S.CHATTOPADHAYA,R.C.PANICKER,X.HUANG,S.Q.YAO |
| Literature Reference Citation | J.AM.CHEM.SOC.,126,14435(2004) |
| Literature Reference DOI | 10.1021/ja047044i |
| Solvent | CD3OD |
| Source File Reference | UWLU34861 |