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3-BENZOYL-2-STEAROYL-RAC-SFINGANIN-1-THIONPHOSPHOCHOLINE
SpectraBase Compound ID CACKUfZs2Zv
InChI InChI=1S/C48H89N2O6PS/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-36-40-47(51)49-45(43-55-57(53,58)54-42-41-50(3,4)5)46(56-48(52)44-37-33-32-34-38-44)39-35-30-28-26-24-22-19-17-15-13-11-9-7-2/h32-34,37-38,45-46H,6-31,35-36,39-43H2,1-5H3,(H-,49,51,53,58)
InChIKey SYNRYWNJIWZXRA-UHFFFAOYSA-N
Mol Weight 853.3 g/mol
Molecular Formula C48H89N2O6PS
Exact Mass 852.617897 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FH3uE11DWHf
Name 3-BENZOYL-2-STEAROYL-RAC-SFINGANIN-1-THIONPHOSPHOCHOLINE
Comments , DRY ORGANIC SOLVENT;MSL-250 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C48H89N2O6PS
InChI InChI=1S/C48H89N2O6PS/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-36-40-47(51)49-45(43-55-57(53,58)54-42-41-50(3,4)5)46(56-48(52)44-37-33-32-34-38-44)39-35-30-28-26-24-22-19-17-15-13-11-9-7-2/h32-34,37-38,45-46H,6-31,35-36,39-43H2,1-5H3,(H-,49,51,53,58)
InChIKey SYNRYWNJIWZXRA-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.YU.FRANTOVA, A.S.BUSHNEV, E.N.ZVONKOVA, V.I.SHVETS (1991)Bioorganich.Khim.(Russ. Lang.): v.17, N11, 1562-1573.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported