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1',2'-DI-(11'-DODECENOYL)-SN-GLYCERO-3-DITHIOPHOSPHOCOLINE

View entire compound with spectra: 2 NMR

1',2'-DI-(11'-DODECENOYL)-SN-GLYCERO-3-DITHIOPHOSPHOCOLINE
SpectraBase Compound ID 1xhOIuFo1Mb
InChI InChI=1S/C32H60NO6PS2/c1-6-8-10-12-14-16-18-20-22-24-31(34)36-28-30(29-38-40(41,42)37-27-26-33(3,4)5)39-32(35)25-23-21-19-17-15-13-11-9-7-2/h6-7,30H,1-2,8-29H2,3-5H3
InChIKey IKZSEDZVPKBSLK-UHFFFAOYSA-N
Mol Weight 649.9 g/mol
Molecular Formula C32H60NO6PS2
Exact Mass 649.359968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2N9qtNH5gkU
Name 1',2'-DI-(11'-DODECENOYL)-SN-GLYCERO-3-DITHIOPHOSPHOCOLINE
Compound Number 25B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H60NO6PS2
InChI InChI=1S/C32H60NO6PS2/c1-6-8-10-12-14-16-18-20-22-24-31(34)36-28-30(29-38-40(41,42)37-27-26-33(3,4)5)39-32(35)25-23-21-19-17-15-13-11-9-7-2/h6-7,30H,1-2,8-29H2,3-5H3
InChIKey IKZSEDZVPKBSLK-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
Molecular Weight 649.925 g/mol
Solvent CDCl3
Source File Reference UWMS26759