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1,2,4,5,6-PENTA-O-ACETYL-3-O-BENZYL-MYO-INOSITOL
SpectraBase Compound ID F8WesDFMOeq
InChI InChI=1S/C23H28O11/c1-12(24)30-19-18(29-11-17-9-7-6-8-10-17)20(31-13(2)25)22(33-15(4)27)23(34-16(5)28)21(19)32-14(3)26/h6-10,18-23H,11H2,1-5H3/t18-,19-,20-,21+,22-,23-/m1/s1
InChIKey XOPSXEJVRYGVOT-FHJOOOADSA-N
Mol Weight 480.47 g/mol
Molecular Formula C23H28O11
Exact Mass 480.163162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BTO3XLaf63a
Name 1,2,4,5,6-PENTA-O-ACETYL-3-O-BENZYL-MYO-INOSITOL
Compound Number (+)-12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28O11
InChI InChI=1S/C23H28O11/c1-12(24)30-19-18(29-11-17-9-7-6-8-10-17)20(31-13(2)25)22(33-15(4)27)23(34-16(5)28)21(19)32-14(3)26/h6-10,18-23H,11H2,1-5H3/t18-,19-,20-,21+,22-,23-/m1/s1
InChIKey XOPSXEJVRYGVOT-FHJOOOADSA-N
Literature Reference Author M.A.L.PODESCHWA,O.PLETTENBURG,H.J.ALTENBACH
Literature Reference Citation EUR.J.ORG.CHEM.,3116(2005)
Molecular Weight 480.469 g/mol
Sample ID 30007
Solvent CDCl3