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3'-O-ACETYLDEOXYTHYMIDINE-5'-1,2,4-TRIAZOLOPHOSPHATE

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3'-O-ACETYLDEOXYTHYMIDINE-5'-1,2,4-TRIAZOLOPHOSPHATE
SpectraBase Compound ID 3SdD35XPJ0w
InChI InChI=1S/C14H18N5O8P/c1-8-4-18(14(22)17-13(8)21)12-3-10(26-9(2)20)11(27-12)5-25-28(23,24)19-7-15-6-16-19/h4,6-7,10-12H,3,5H2,1-2H3,(H,23,24)(H,17,21,22)/t10-,11+,12+/m0/s1
InChIKey DJKNVMPZKTWSOW-QJPTWQEYSA-N
Mol Weight 415.3 g/mol
Molecular Formula C14H18N5O8P
Exact Mass 415.0893 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3vDNX298jAx
Name 3'-O-ACETYLDEOXYTHYMIDINE-5'-1,2,4-TRIAZOLOPHOSPHATE
Comments , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H18N5O8P
InChI InChI=1S/C14H18N5O8P/c1-8-4-18(14(22)17-13(8)21)12-3-10(26-9(2)20)11(27-12)5-25-28(23,24)19-7-15-6-16-19/h4,6-7,10-12H,3,5H2,1-2H3,(H,23,24)(H,17,21,22)/t10-,11+,12+/m0/s1
InChIKey DJKNVMPZKTWSOW-QJPTWQEYSA-N
Instrument Name Bruker HX-90
Literature Reference A.V.LEBEDEV, A.I.REZVUKHIN (1983) Bioorganich.Khim.(Russ. Lang.): v.9, N2, 149-185.
NMR Standard -H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C5H5N pyridine