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O-(3-BENZOYL-2-STEAROYL-RAC-SFINGANIN-1-YL)-O-(2-CYANOETHYL)-O-(2-DIMETHYLAMINOETHYL)PHOSPHITE
SpectraBase Compound ID CpfOslPKp6Q
InChI InChI=1S/C50H90N3O6P/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-35-40-49(54)52-47(45-58-60(56-43-36-41-51)57-44-42-53(3)4)48(59-50(55)46-37-32-31-33-38-46)39-34-29-27-25-23-21-18-16-14-12-10-8-6-2/h31-33,37-38,47-48H,5-30,34-36,39-40,42-45H2,1-4H3,(H,52,54)
InChIKey VNTCJJKMEMLFEP-UHFFFAOYSA-N
Mol Weight 860.3 g/mol
Molecular Formula C50H90N3O6P
Exact Mass 859.656725 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J4tMJZPQeQV
Name O-(3-BENZOYL-2-STEAROYL-RAC-SFINGANIN-1-YL)-O-(2-CYANOETHYL)-O-(2-DIMETHYLAMINOETHYL)PHOSPHITE
Comments , DRY ORGANIC SOLVENT;MSL-250 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C50H90N3O6P
InChI InChI=1S/C50H90N3O6P/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-35-40-49(54)52-47(45-58-60(56-43-36-41-51)57-44-42-53(3)4)48(59-50(55)46-37-32-31-33-38-46)39-34-29-27-25-23-21-18-16-14-12-10-8-6-2/h31-33,37-38,47-48H,5-30,34-36,39-40,42-45H2,1-4H3,(H,52,54)
InChIKey VNTCJJKMEMLFEP-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