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1-BETA-[2-(N,N-DIMETHYL-AMINO)-BENZYL]-1-DEOXY-D-RIBOFURANOSIDE-MONOPHOSPHATE

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1-BETA-[2-(N,N-DIMETHYL-AMINO)-BENZYL]-1-DEOXY-D-RIBOFURANOSIDE-MONOPHOSPHATE
SpectraBase Compound ID 4OkZfuZBG6v
InChI InChI=1S/C14H22NO7P.Na/c1-15(2)10-6-4-3-5-9(10)7-11-13(16)14(17)12(22-11)8-21-23(18,19)20;/h3-6,11-14,16-17H,7-8H2,1-2H3,(H2,18,19,20);/q;+1/p-1/t11-,12+,13-,14+;/m0./s1
InChIKey KMNXXTYLOWVWMO-BHARVXRSSA-M
Mol Weight 369.29 g/mol
Molecular Formula C14H21NNaO7P
Exact Mass 369.095333 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4vBAD7g4k5b
Name 1-BETA-[2-(N,N-DIMETHYL-AMINO)-BENZYL]-1-DEOXY-D-RIBOFURANOSIDE-MONOPHOSPHATE
Compound Number 8F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20NNaO7P
InChI InChI=1S/C14H22NO7P.Na/c1-15(2)10-6-4-3-5-9(10)7-11-13(16)14(17)12(22-11)8-21-23(18,19)20;/h3-6,11-14,16-17H,7-8H2,1-2H3,(H2,18,19,20);/q;+1/p-1/t11-,12+,13-,14+;/m0./s1
InChIKey KMNXXTYLOWVWMO-BHARVXRSSA-M
Literature Reference Author T.KUBELKA,L.SLAVETINSKA,M.HOCEK
Literature Reference Citation EUR.J.ORG.CHEM.,2012,4969(2012)
Literature Reference DOI 10.1002/ejoc.201200819
Solvent D2O
Source File Reference UWLU84123