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AJRLEODOBBWBIW-URVWBBJESA-N
SpectraBase Compound ID LnIOLEjmSHi
InChI InChI=1S/C88H94O16P2/c89-105(99-65-75-45-23-7-24-46-75,100-66-76-47-25-8-26-48-76)57-53-79-81(93-59-69-33-11-1-12-34-69)83(95-61-71-37-15-3-16-38-71)85(97-63-73-41-19-5-20-42-73)87(103-79)91-55-31-32-56-92-88-86(98-64-74-43-21-6-22-44-74)84(96-62-72-39-17-4-18-40-72)82(94-60-70-35-13-2-14-36-70)80(104-88)54-58-106(90,101-67-77-49-27-9-28-50-77)102-68-78-51-29-10-30-52-78/h1-52,79-88H,53-68H2/b32-31+/t79-,80-,81-,82-,83+,84+,85+,86+,87+,88+/m0/s1
InChIKey AJRLEODOBBWBIW-URVWBBJESA-N
Mol Weight 1469.7 g/mol
Molecular Formula C88H94O16P2
Exact Mass 1468.601711 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EAu1Gw7Z2zn
Name AJRLEODOBBWBIW-URVWBBJESA-N
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C88H94O16P2
InChI InChI=1S/C88H94O16P2/c89-105(99-65-75-45-23-7-24-46-75,100-66-76-47-25-8-26-48-76)57-53-79-81(93-59-69-33-11-1-12-34-69)83(95-61-71-37-15-3-16-38-71)85(97-63-73-41-19-5-20-42-73)87(103-79)91-55-31-32-56-92-88-86(98-64-74-43-21-6-22-44-74)84(96-62-72-39-17-4-18-40-72)82(94-60-70-35-13-2-14-36-70)80(104-88)54-58-106(90,101-67-77-49-27-9-28-50-77)102-68-78-51-29-10-30-52-78/h1-52,79-88H,53-68H2/b32-31+/t79-,80-,81-,82-,83+,84+,85+,86+,87+,88+/m0/s1
InChIKey AJRLEODOBBWBIW-URVWBBJESA-N
Literature Reference Author D.B.BERKOWITZ,G.MAITI,B.D.CHARETTE,C.D.DREIS,R.G.M.DONALD
Literature Reference Citation ORG.LETTERS,6,4921(2004)
Literature Reference DOI 10.1021/ol0479444
Solvent CDCl3
Source File Reference UWLU50156