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3,6-DI-O-BENZYL-4,5-BIS-O-(3-OXO-1,5-DIHYDRO-3-LAMBDA(5)-2,4,3-BENZODIOXAPHOSPHEPIN-3-YL)-D-MYO-INOSITOL
SpectraBase Compound ID AM7Hbcekt6D
InChI InChI=1S/C36H38O12P2/c37-31-32(38)34(42-20-26-13-5-2-6-14-26)36(48-50(40)45-23-29-17-9-10-18-30(29)24-46-50)35(33(31)41-19-25-11-3-1-4-12-25)47-49(39)43-21-27-15-7-8-16-28(27)22-44-49/h1-18,31-38H,19-24H2/t31-,32+,33-,34-,35+,36+/m0/s1
InChIKey NWJHLCUAEJPXPT-JGWITIFNSA-N
Mol Weight 724.6 g/mol
Molecular Formula C36H38O12P2
Exact Mass 724.183851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID COATunbgs5J
Name 3,6-DI-O-BENZYL-4,5-BIS-O-(3-OXO-1,5-DIHYDRO-3-LAMBDA(5)-2,4,3-BENZODIOXAPHOSPHEPIN-3-YL)-D-MYO-INOSITOL
Compound Number (-)-21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H38O12P2
InChI InChI=1S/C36H38O12P2/c37-31-32(38)34(42-20-26-13-5-2-6-14-26)36(48-50(40)45-23-29-17-9-10-18-30(29)24-46-50)35(33(31)41-19-25-11-3-1-4-12-25)47-49(39)43-21-27-15-7-8-16-28(27)22-44-49/h1-18,31-38H,19-24H2/t31-,32+,33-,34-,35+,36+/m0/s1
InChIKey NWJHLCUAEJPXPT-JGWITIFNSA-N
Literature Reference Author M.A.L.PODESCHWA,O.PLETTENBURG,H.J.ALTENBACH
Literature Reference Citation EUR.J.ORG.CHEM.,3101(2005)
Molecular Weight 724.638 g/mol
Sample ID 29979
Solvent CDCl3