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1,2-DI-(11'-HYDROXYUNDECANOYL)-SN-GLYCERO-3-DITHIOPHOSPHOCOLINE
SpectraBase Compound ID J2Hh1h2TNTR
InChI InChI=1S/C30H60NO8PS2/c1-31(2,3)22-25-37-40(41,42)38-27-28(39-30(35)21-17-13-9-5-7-11-15-19-24-33)26-36-29(34)20-16-12-8-4-6-10-14-18-23-32/h28,32-33H,4-27H2,1-3H3
InChIKey NPLFFWJKCUJCIV-UHFFFAOYSA-N
Mol Weight 657.9 g/mol
Molecular Formula C30H60NO8PS2
Exact Mass 657.349797 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Afd6ZqbPcJn
Name 1,2-DI-(11'-HYDROXYUNDECANOYL)-SN-GLYCERO-3-DITHIOPHOSPHOCOLINE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H60NO8PS2
InChI InChI=1S/C30H60NO8PS2/c1-31(2,3)22-25-37-40(41,42)38-27-28(39-30(35)21-17-13-9-5-7-11-15-19-24-33)26-36-29(34)20-16-12-8-4-6-10-14-18-23-32/h28,32-33H,4-27H2,1-3H3
InChIKey NPLFFWJKCUJCIV-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 657.902 g/mol
Solvent DMSO-D6
Source File Reference UWMS26761