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TETRAKIS-(ALPHA-HYDROXYDODECYL)-PHOSPHONIUM_CHLORIDE;MINIMUM_ISOMER

View entire compound with spectra: 4 NMR

TETRAKIS-(ALPHA-HYDROXYDODECYL)-PHOSPHONIUM_CHLORIDE;MINIMUM_ISOMER
SpectraBase Compound ID 9NL4tlgTgSJ
InChI InChI=1S/C48H100O4P.ClH/c1-5-9-13-17-21-25-29-33-37-41-45(49)53(46(50)42-38-34-30-26-22-18-14-10-6-2,47(51)43-39-35-31-27-23-19-15-11-7-3)48(52)44-40-36-32-28-24-20-16-12-8-4;/h45-52H,5-44H2,1-4H3;1H/q+1;/p-1/t45-,46-,47+,48+;
InChIKey QKOFGZLILRFQOV-LFDCRLCXSA-M
Mol Weight 807.8 g/mol
Molecular Formula C48H100ClO4P
Exact Mass 806.704776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1uCXShdykmj
Name TETRAKIS-(ALPHA-HYDROXYDODECYL)-PHOSPHONIUM_CHLORIDE;MINIMUM_ISOMER
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H100ClO4P
InChI InChI=1S/C48H100O4P.ClH/c1-5-9-13-17-21-25-29-33-37-41-45(49)53(46(50)42-38-34-30-26-22-18-14-10-6-2,47(51)43-39-35-31-27-23-19-15-11-7-3)48(52)44-40-36-32-28-24-20-16-12-8-4;/h45-52H,5-44H2,1-4H3;1H/q+1;/p-1/t45-,46-,47+,48+;
InChIKey QKOFGZLILRFQOV-LFDCRLCXSA-M
Literature Reference Author D.ALBOUY,A.BRUN,A.MUNOZ,G.E.MOGHADAM
Literature Reference Citation J.ORG.CHEM.,63,7223(1998)
Literature Reference DOI 10.1021/jo9805551
Molecular Weight 807.746 g/mol
Sample ID 26244
Solvent C6D6