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2-[(1S,2R,3S)-1,2,3-TRIS-(BENZYLOXY)-4-(TRITYLOXY)-BUTYL]-4,5,6,7-TETRAHYDRO-1H-BENZIMIDAZOLE

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2-[(1S,2R,3S)-1,2,3-TRIS-(BENZYLOXY)-4-(TRITYLOXY)-BUTYL]-4,5,6,7-TETRAHYDRO-1H-BENZIMIDAZOLE
SpectraBase Compound ID 44sCvAGeTMl
InChI InChI=1S/C51H50N2O4/c1-7-21-39(22-8-1)35-54-47(38-57-51(42-27-13-4-14-28-42,43-29-15-5-16-30-43)44-31-17-6-18-32-44)48(55-36-40-23-9-2-10-24-40)49(56-37-41-25-11-3-12-26-41)50-52-45-33-19-20-34-46(45)53-50/h1-18,21-32,47-49H,19-20,33-38H2,(H,52,53)/t47-,48+,49+/m0/s1
InChIKey CYICJXIMFJMEFN-HZQFSHEBSA-N
Mol Weight 755.0 g/mol
Molecular Formula C51H50N2O4
Exact Mass 754.377058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 641gSZ2tFPi
Name 2-[(1S,2R,3S)-1,2,3-TRIS-(BENZYLOXY)-4-(TRITYLOXY)-BUTYL]-4,5,6,7-TETRAHYDRO-1H-BENZIMIDAZOLE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H50N2O4
InChI InChI=1S/C51H50N2O4/c1-7-21-39(22-8-1)35-54-47(38-57-51(42-27-13-4-14-28-42,43-29-15-5-16-30-43)44-31-17-6-18-32-44)48(55-36-40-23-9-2-10-24-40)49(56-37-41-25-11-3-12-26-41)50-52-45-33-19-20-34-46(45)53-50/h1-18,21-32,47-49H,19-20,33-38H2,(H,52,53)/t47-,48+,49+/m0/s1
InChIKey CYICJXIMFJMEFN-HZQFSHEBSA-N
Literature Reference Author E.DUBOST,D.L.NOUEN,J.STREITH,C.TARNUS,T.TSCHAMBER
Literature Reference Citation EUR.J.ORG.CHEM.,610(2006)
Molecular Weight 754.969 g/mol
Sample ID 43030
Solvent CDCl3