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1,2-DIBUTANOYL-SN-GLYCERO-3-DITHIOPHOSPHOCHOLINE
SpectraBase Compound ID FncQMqadhTW
InChI InChI=1S/C16H32NO6PS2/c1-6-8-15(18)20-12-14(23-16(19)9-7-2)13-22-24(25,26)21-11-10-17(3,4)5/h14H,6-13H2,1-5H3
InChIKey KFLUKWRRSAMSGS-UHFFFAOYSA-N
Mol Weight 429.5 g/mol
Molecular Formula C16H32NO6PS2
Exact Mass 429.140867 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FZ6IQ655ZuK
Name 1,2-DIBUTANOYL-SN-GLYCERO-3-DITHIOPHOSPHOCHOLINE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H32NO6PS2
InChI InChI=1S/C16H32NO6PS2/c1-6-8-15(18)20-12-14(23-16(19)9-7-2)13-22-24(25,26)21-11-10-17(3,4)5/h14H,6-13H2,1-5H3
InChIKey KFLUKWRRSAMSGS-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 429.527 g/mol
Solvent CDCl3
Source File Reference UWMS26755