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1,2-DISTEAROYL-3-RAC-GLYCEROPHOSPHORYL-2'-BENZYLOXYHOMOCHOLINE
SpectraBase Compound ID HnGyGjg9bII
InChI InChI=1S/C52H96NO9P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-37-41-51(54)59-45-50(62-52(55)42-38-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)47-61-63(56,57)60-46-49(43-53(3,4)5)58-44-48-39-35-34-36-40-48/h34-36,39-40,49-50H,6-33,37-38,41-47H2,1-5H3
InChIKey CELUTOKOJSVZNV-UHFFFAOYSA-N
Mol Weight 910.3 g/mol
Molecular Formula C52H96NO9P
Exact Mass 909.682271 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EmjOE2LdzDF
Name 1,2-DISTEAROYL-3-RAC-GLYCEROPHOSPHORYL-2'-BENZYLOXYHOMOCHOLINE
Comments , SCALE INVERTED
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Formula C52H96NO9P
InChI InChI=1S/C52H96NO9P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-37-41-51(54)59-45-50(62-52(55)42-38-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)47-61-63(56,57)60-46-49(43-53(3,4)5)58-44-48-39-35-34-36-40-48/h34-36,39-40,49-50H,6-33,37-38,41-47H2,1-5H3
InChIKey CELUTOKOJSVZNV-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference D.A.PREDVODITELEV, T.G.CHUKBAR, T.P.ZELENEVA, E.E.NIFANT'EV (1981)Zhurn.Org.Khim.(Russ. Lang.): v.17, N6, 1305-1315.
NMR Standard -H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CHCl3 chloroform