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GWMXQUPJFNFOIC-PESVTNAGSA-N

View entire compound with spectra: 2 NMR

GWMXQUPJFNFOIC-PESVTNAGSA-N
SpectraBase Compound ID K3xJ41bE0AF
InChI InChI=1S/C56H64N20O8P4/c1-69-57-37-45-29-30-47(65-45)39-59-71(3)86(78,82-54-23-15-10-16-24-54)73(5)61-41-49-33-34-51(67-49)43-63-75(7)88(80,84-56-27-19-12-20-28-56)76(8)64-44-52-36-35-50(68-52)42-62-74(6)87(79,83-55-25-17-11-18-26-55)72(4)60-40-48-32-31-46(66-48)38-58-70(2)85(69,77)81-53-21-13-9-14-22-53/h9-44,65-68H,1-8H3/b57-37-,58-38+,59-39+,60-40-,61-41+,62-42+,63-43+,64-44+
InChIKey GWMXQUPJFNFOIC-PESVTNAGSA-N
Mol Weight 1269.2 g/mol
Molecular Formula C56H64N20O8P4
Exact Mass 1268.416647 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L3BQejzRKrq
Name GWMXQUPJFNFOIC-PESVTNAGSA-N
Compound Number 9'''
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H64N20O8P4
InChI InChI=1S/C56H64N20O8P4/c1-69-57-37-45-29-30-47(65-45)39-59-71(3)86(78,82-54-23-15-10-16-24-54)73(5)61-41-49-33-34-51(67-49)43-63-75(7)88(80,84-56-27-19-12-20-28-56)76(8)64-44-52-36-35-50(68-52)42-62-74(6)87(79,83-55-25-17-11-18-26-55)72(4)60-40-48-32-31-46(66-48)38-58-70(2)85(69,77)81-53-21-13-9-14-22-53/h9-44,65-68H,1-8H3/b57-37-,58-38+,59-39+,60-40-,61-41+,62-42+,63-43+,64-44+
InChIKey GWMXQUPJFNFOIC-PESVTNAGSA-N
Literature Reference Author B.OUSSAID,B.GARRIGUES,J.JAUD,A.M.CAMINADE,J.P.MAJORAL
Literature Reference Citation J.ORG.CHEM.,58,4500(1993)
Literature Reference DOI 10.1021/jo00068a061
Molecular Weight 1269.148 g/mol
Solvent CDCl3
Source File Reference UWSP10064