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#11;N-ALPHA-(FLUOREN-9-YL-METHOXYCARBONYL)-O-[2,3,4-TRI-O-BENZOYL-6-O-[2,3,4-TRI-O-BENZOYL-6-O-BIS-(2,2,2-TRICHLOROETHOXY)-PHOSPHORYL-ALPHA-D-MANNOPYRANOSYL]
SpectraBase Compound ID J1leKitneZy
InChI InChI=1S/C83H65Cl6F5NO24P/c1-45(64(78(102)115-67-62(93)60(91)59(90)61(92)63(67)94)95-81(103)106-40-56-54-38-22-20-36-52(54)53-37-21-23-39-55(53)56)110-80-71(119-77(101)51-34-18-7-19-35-51)69(117-75(99)49-30-14-5-15-31-49)65(113-72(96)46-24-8-2-9-25-46)57(112-80)41-105-79-70(118-76(100)50-32-16-6-17-33-50)68(116-74(98)48-28-12-4-13-29-48)66(114-73(97)47-26-10-3-11-27-47)58(111-79)42-107-120(104,108-43-82(84,85)86)109-44-83(87,88)89/h2-39,45,56-58,64-66,68-71,79-80H,40-44H2,1H3,(H,95,103)/t45-,57-,58+,64-,65-,66+,68-,69+,70-,71+,79-,80+/m1/s1
InChIKey DUDRMPYTEJSSPN-MTRCKNIBSA-N
Mol Weight 1799.1 g/mol
Molecular Formula C83H65Cl6F5NO24P
Exact Mass 1795.168546 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Ad1b3F7bk
Name #11;N-ALPHA-(FLUOREN-9-YL-METHOXYCARBONYL)-O-[2,3,4-TRI-O-BENZOYL-6-O-[2,3,4-TRI-O-BENZOYL-6-O-BIS-(2,2,2-TRICHLOROETHOXY)-PHOSPHORYL-ALPHA-D-MANNOPYRANOSYL]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C83H65Cl6F5NO24P
InChI InChI=1S/C83H65Cl6F5NO24P/c1-45(64(78(102)115-67-62(93)60(91)59(90)61(92)63(67)94)95-81(103)106-40-56-54-38-22-20-36-52(54)53-37-21-23-39-55(53)56)110-80-71(119-77(101)51-34-18-7-19-35-51)69(117-75(99)49-30-14-5-15-31-49)65(113-72(96)46-24-8-2-9-25-46)57(112-80)41-105-79-70(118-76(100)50-32-16-6-17-33-50)68(116-74(98)48-28-12-4-13-29-48)66(114-73(97)47-26-10-3-11-27-47)58(111-79)42-107-120(104,108-43-82(84,85)86)109-44-83(87,88)89/h2-39,45,56-58,64-66,68-71,79-80H,40-44H2,1H3,(H,95,103)/t45-,57-,58+,64-,65-,66+,68-,69+,70-,71+,79-,80+/m1/s1
InChIKey DUDRMPYTEJSSPN-MTRCKNIBSA-N
Literature Reference Author M.K.CHRISTENSEN,M.MELDAL,K.BOCK
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1453(1993)
Literature Reference DOI 10.1039/p19930001453
Molecular Weight 1799.105 g/mol
Solvent CDCl3
Source File Reference UWCP6265