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3,5-DIDEOXY-D-MYO-INOSITOL-1-PHOSPHATE-BISCYCLOHEXYLAMINE-SALT

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3,5-DIDEOXY-D-MYO-INOSITOL-1-PHOSPHATE-BISCYCLOHEXYLAMINE-SALT
SpectraBase Compound ID 3uuxc8FIjua
InChI InChI=1S/2C6H13N.C6H13O7P/c2*7-6-4-2-1-3-5-6;7-3-1-4(8)6(5(9)2-3)13-14(10,11)12/h2*6H,1-5,7H2;3-9H,1-2H2,(H2,10,11,12)/t;;3-,4-,5-,6-/m..0/s1
InChIKey OWDYLTGNONRIHM-VWKZOJSJSA-N
Mol Weight 426.49 g/mol
Molecular Formula C18H39N2O7P
Exact Mass 426.249489 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jk4umGCQNwc
Name 3,5-DIDEOXY-D-MYO-INOSITOL-1-PHOSPHATE-BISCYCLOHEXYLAMINE-SALT
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H39N2O7P
InChI InChI=1S/2C6H13N.C6H13O7P/c2*7-6-4-2-1-3-5-6;7-3-1-4(8)6(5(9)2-3)13-14(10,11)12/h2*6H,1-5,7H2;3-9H,1-2H2,(H2,10,11,12)/t;;3-,4-,5-,6-/m..0/s1
InChIKey OWDYLTGNONRIHM-VWKZOJSJSA-N
Literature Reference Author A.J.MORGAN,Y.K.WANG,M.F.ROBERTS,S.J.MILLER
Literature Reference Citation J.AM.CHEM.SOC.,126,15370(2004)
Literature Reference DOI 10.1021/ja047360x
Solvent D2O
Source File Reference UWLU34843