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1-(1,4-DIHYDROXYPENTYL-2)THYMINE-1'-PHOSPHATE

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1-(1,4-DIHYDROXYPENTYL-2)THYMINE-1'-PHOSPHATE
SpectraBase Compound ID 8Cw4qvr72F4
InChI InChI=1S/C10H17N2O7P/c1-6-4-12(10(15)11-9(6)14)8(3-7(2)13)5-19-20(16,17)18/h4,7-8,13H,3,5H2,1-2H3,(H,11,14,15)(H2,16,17,18)
InChIKey ZFTODEKCFFSIMV-UHFFFAOYSA-N
Mol Weight 308.23 g/mol
Molecular Formula C10H17N2O7P
Exact Mass 308.077338 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AZExN8FHl2J
Name 1-(1,4-DIHYDROXYPENTYL-2)THYMINE-1'-PHOSPHATE
Comments , SCALE INVERTED
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Formula C10H17N2O7P
InChI InChI=1S/C10H17N2O7P/c1-6-4-12(10(15)11-9(6)14)8(3-7(2)13)5-19-20(16,17)18/h4,7-8,13H,3,5H2,1-2H3,(H,11,14,15)(H2,16,17,18)
InChIKey ZFTODEKCFFSIMV-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference S.A.GILLER, L.A.SHERIN', D.E.ZARIN', R.A.ZHUK (1978) Khim.Heteroc.Soed.(Russ.Lang.): N5, 678-683.
NMR Standard -H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent H2O water