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6-O-BENZYL-2,3:4,5-DI-O-CYCLOHEXYLIDENE-1-D-MYO-INOSITOL
SpectraBase Compound ID LZyjzrFIPrn
InChI InChI=1S/C25H34O6/c26-18-19(27-16-17-10-4-1-5-11-17)21-23(31-25(29-21)14-8-3-9-15-25)22-20(18)28-24(30-22)12-6-2-7-13-24/h1,4-5,10-11,18-23,26H,2-3,6-9,12-16H2/t18-,19-,20-,21+,22-,23-/m0/s1
InChIKey IADVUVVIWYXFFK-FHEJEKGWSA-N
Mol Weight 430.5 g/mol
Molecular Formula C25H34O6
Exact Mass 430.235539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9RyjJ2DDxx8
Name 6-O-BENZYL-2,3:4,5-DI-O-CYCLOHEXYLIDENE-1-D-MYO-INOSITOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H34O6
InChI InChI=1S/C25H34O6/c26-18-19(27-16-17-10-4-1-5-11-17)21-23(31-25(29-21)14-8-3-9-15-25)22-20(18)28-24(30-22)12-6-2-7-13-24/h1,4-5,10-11,18-23,26H,2-3,6-9,12-16H2/t18-,19-,20-,21+,22-,23-/m0/s1
InChIKey IADVUVVIWYXFFK-FHEJEKGWSA-N
Literature Reference Author G.M.NICHOLAS,P.KOVAC,C.A.BEWLEY
Literature Reference Citation J.AM.CHEM.SOC.,124,3492(2002)
Literature Reference DOI 10.1021/ja017891a
Molecular Weight 430.541 g/mol
Sample ID 33617
Solvent CD3OD