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2,2-DI(PALMITOYLOXYMETHYL)BUTOXY-1-THIOLPHOSPHOHOMOCHOLINE
SpectraBase Compound ID 3KWRiUTVaqX
InChI InChI=1S/C44H88NO7PS/c1-7-10-12-14-16-18-20-22-24-26-28-30-32-35-42(46)50-39-44(9-3,41-52-53(48,49)54-38-34-37-45(4,5)6)40-51-43(47)36-33-31-29-27-25-23-21-19-17-15-13-11-8-2/h7-41H2,1-6H3
InChIKey CZNLYCWRCNPFKX-UHFFFAOYSA-N
Mol Weight 806.2 g/mol
Molecular Formula C44H88NO7PS
Exact Mass 805.601912 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B8PLAy8iXfP
Name 2,2-DI(PALMITOYLOXYMETHYL)BUTOXY-1-THIOLPHOSPHOHOMOCHOLINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C44H88NO7PS
InChI InChI=1S/C44H88NO7PS/c1-7-10-12-14-16-18-20-22-24-26-28-30-32-35-42(46)50-39-44(9-3,41-52-53(48,49)54-38-34-37-45(4,5)6)40-51-43(47)36-33-31-29-27-25-23-21-19-17-15-13-11-8-2/h7-41H2,1-6H3
InChIKey CZNLYCWRCNPFKX-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference E.E.NIFANT'EV, D.A.PREDVODITELEV, G.A.SAVIN (1991) Bioorganich.Khim.(Russ.Lang.): v.17, N1, 126-135.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CHCl3 chloroform