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2'-DEOXY-2'-FLUORO-2'-METHYL-BETA-NICOTINAMIDE-MONONUCLEOTIDE
SpectraBase Compound ID 9AtRLfEdLVP
InChI InChI=1S/C12H16FN2O7P/c1-12(13)9(16)8(6-21-23(18,19)20)22-11(12)15-4-2-3-7(5-15)10(14)17/h2-5,8-9,11,16H,6H2,1H3,(H3-,14,17,18,19,20)/p+1/t8-,9-,11-,12-/m0/s1
InChIKey GKQOHCLNWDNNAD-QSFUFRPTSA-O
Mol Weight 351.25 g/mol
Molecular Formula C12H17FN2O7P
Exact Mass 351.075741 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GBuf72lSlZP
Name 2'-DEOXY-2'-FLUORO-2'-METHYL-BETA-NICOTINAMIDE-MONONUCLEOTIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15FN2O7P
InChI InChI=1S/C12H16FN2O7P/c1-12(13)9(16)8(6-21-23(18,19)20)22-11(12)15-4-2-3-7(5-15)10(14)17/h2-5,8-9,11,16H,6H2,1H3,(H3-,14,17,18,19,20)/p+1/t8-,9-,11-,12-/m0/s1
InChIKey GKQOHCLNWDNNAD-QSFUFRPTSA-O
Literature Reference Author S.WANG,W.ZHU,X.WANG,J.LI,K.ZHANG,L.ZHANG,Y.J.ZHAO,H.C.LEE,L. ZHANG
Literature Reference Citation MOLECULES,19,15754(2014)
Literature Reference DOI 10.3390/molecules191015754
Solvent D2O
Source File Reference UWLU81446