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1,2-DI-(6'-HYDROXYHEXANOYL)-SN-GLYCERO-3-DITHIOPHOSPHOCOLINE
SpectraBase Compound ID 6G0KqnaMby3
InChI InChI=1S/C20H40NO8PS2/c1-21(2,3)12-15-27-30(31,32)28-17-18(29-20(25)11-7-5-9-14-23)16-26-19(24)10-6-4-8-13-22/h18,22-23H,4-17H2,1-3H3
InChIKey PCVXRRHGROROHS-UHFFFAOYSA-N
Mol Weight 517.6 g/mol
Molecular Formula C20H40NO8PS2
Exact Mass 517.193297 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Pn5KVqdhmt
Name 1,2-DI-(6'-HYDROXYHEXANOYL)-SN-GLYCERO-3-DITHIOPHOSPHOCOLINE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H40NO8PS2
InChI InChI=1S/C20H40NO8PS2/c1-21(2,3)12-15-27-30(31,32)28-17-18(29-20(25)11-7-5-9-14-23)16-26-19(24)10-6-4-8-13-22/h18,22-23H,4-17H2,1-3H3
InChIKey PCVXRRHGROROHS-UHFFFAOYSA-N
Literature Reference Author C.L.FRANKLIN,H.LI,S.F.MARTIN
Literature Reference Citation J.ORG.CHEM.,68,7298(2003)
Literature Reference DOI 10.1021/jo034411k
Solvent CD3OD
Source File Reference UWMS26762