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(1,2-DIPALMITOYL-RAC-GLYCERO-3)(4-METHYL-2,6-DI-TERT-BUTYLPHENYL)CHLOROPHOSPHATE (DIASTEREOMER MIXTURE)
SpectraBase Compound ID bfWENJ4M8G
InChI InChI=1S/C50H90ClO7P/c1-10-12-14-16-18-20-22-24-26-28-30-32-34-36-46(52)55-40-43(57-47(53)37-35-33-31-29-27-25-23-21-19-17-15-13-11-2)41-56-59(51,54)58-48-44(49(4,5)6)38-42(3)39-45(48)50(7,8)9/h38-39,43H,10-37,40-41H2,1-9H3
InChIKey AGGDSUXUAFTSJB-UHFFFAOYSA-N
Mol Weight 869.7 g/mol
Molecular Formula C50H90ClO7P
Exact Mass 868.61127 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K1wM3M45QM0
Name (1,2-DIPALMITOYL-RAC-GLYCERO-3)(4-METHYL-2,6-DI-TERT-BUTYLPHENYL)CHLOROPHOSPHATE (DIASTEREOMER MIXTURE)
Comments , I(-7.19):I(-7.71)=7:10
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C50H90ClO7P
InChI InChI=1S/C50H90ClO7P/c1-10-12-14-16-18-20-22-24-26-28-30-32-34-36-46(52)55-40-43(57-47(53)37-35-33-31-29-27-25-23-21-19-17-15-13-11-2)41-56-59(51,54)58-48-44(49(4,5)6)38-42(3)39-45(48)50(7,8)9/h38-39,43H,10-37,40-41H2,1-9H3
InChIKey AGGDSUXUAFTSJB-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference E.E.NIFANT'EV, D.A.PREDVODITELEV, M.A.ZOLOTOV (1982) Bioorganich.Khim.(Russ.Lang.): v.8, N9, 1263-1268.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6H6 benzene