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3-O-(1,3-PROPYLENDIOXYTHIOPHOSPHORYL)-5,6-O-DISTEAROYL-L-ASCORBINICACID
SpectraBase Compound ID 6uGrDba3bJ7
InChI InChI=1S/C45H81O10PS/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-40(46)50-38-39(43-44(42(48)45(49)54-43)55-56(57)51-36-33-37-52-56)53-41(47)35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h39,43,48H,3-38H2,1-2H3
InChIKey DLESJTKJUOXFJT-UHFFFAOYSA-N
Mol Weight 845.2 g/mol
Molecular Formula C45H81O10PS
Exact Mass 844.528807 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HUSewfWp7Kt
Name 3-O-(1,3-PROPYLENDIOXYTHIOPHOSPHORYL)-5,6-O-DISTEAROYL-L-ASCORBINICACID
Comments , I(56.36):I(56.43)=10:1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C45H81O10PS
InChI InChI=1S/C45H81O10PS/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-40(46)50-38-39(43-44(42(48)45(49)54-43)55-56(57)51-36-33-37-52-56)53-41(47)35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h39,43,48H,3-38H2,1-2H3
InChIKey DLESJTKJUOXFJT-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference D.A.PREDVODITELEV, M.A.MALENKOVSKAYA, A.R.BEKKER, L.K.VASYANINA, E.E.NIFANT'EV(1991) Zhurn.Org.Khim.(Russ. Lang.): v.27, N8, 1655-1668.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CHCl3 chloroform