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DICYCLOHEXYLAMMONIUM-(4-DICYCLOHEXYLAMMONIUMPHOSPHONO-3-OXO-2R-HYDROXYBUTYL)-PHOSPHATE

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DICYCLOHEXYLAMMONIUM-(4-DICYCLOHEXYLAMMONIUMPHOSPHONO-3-OXO-2R-HYDROXYBUTYL)-PHOSPHATE
SpectraBase Compound ID IG0fZtXAeew
InChI InChI=1S/4C6H13N.C4H10O9P2/c4*7-6-4-2-1-3-5-6;5-3(1-13-15(10,11)12)4(6)2-14(7,8)9/h4*6H,1-5,7H2;3,5H,1-2H2,(H2,7,8,9)(H2,10,11,12)/t;;;;3-/m....0/s1
InChIKey DFFGSAIDUDSCIQ-OLUGJTGJSA-N
Mol Weight 660.77 g/mol
Molecular Formula C28H62N4O9P2
Exact Mass 660.399204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6GIzwk8d41H
Name DICYCLOHEXYLAMMONIUM-(4-DICYCLOHEXYLAMMONIUMPHOSPHONO-3-OXO-2R-HYDROXYBUTYL)-PHOSPHATE
Compound Number 1E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H62N4O9P2
InChI InChI=1S/4C6H13N.C4H10O9P2/c4*7-6-4-2-1-3-5-6;5-3(1-13-15(10,11)12)4(6)2-14(7,8)9/h4*6H,1-5,7H2;3,5H,1-2H2,(H2,7,8,9)(H2,10,11,12)/t;;;;3-/m....0/s1
InChIKey DFFGSAIDUDSCIQ-OLUGJTGJSA-N
Literature Reference Author S.LADAME,M.BARDET,J.PERIE,M.WILLSON
Literature Reference Citation BIOORG.MED.CHEM.,9,773(2001)
Literature Reference DOI 10.1016/S0968-0896(00)00295-9
Molecular Weight 660.769 g/mol
Solvent D2O
Source File Reference UWLU21883